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チバメート

Tybamate

HCID 20266
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
部分構造検索類似構造を探す

基本情報

CAS
4268-36-4
標準SMILES
CCCCNC(=O)OCC(C)(CCC)COC(N)=O
InChIKey
PRBORDFJHHAISJ-UHFFFAOYSA-N
分子式
C13H26N2O4
平均分子量
274.36 g/mol
単同位体質量
274.18925731

概要

Tybamate is a carbamate ester.

名称と識別子

優先名称
Tybamate
IUPAC
[2-(carbamoyloxymethyl)-2-methylpentyl] N-butylcarbamate
現地名
チバメート
英語名
tybamate
分子式
C13H26N2O4
分子量
274.36

名称と別名

TYBAMATETibamatoTybatranSolacenEffisaxSolacinTibamateTibamaxBenvilNospanDepranIdalene
名称をさらに表示
ソラセンチバトランN-ブチルカルバミド酸2-[[(アミノカルボニル)オキシ]メチル]-2-メチルペンチルチバマートベンビル2-メチル-2-プロピル-1,3-プロパンジオール1-ブチルカルバマート3-カルバマートエフィサックスノスパンソラシンチバメート2-[(カルバモイルオキシ)メチル]-2-メチルペンチル N-ブチルカルバマート[2-(carbamoyloxymethyl)-2-methylpentyl] N-butylcarbamate[2-(aminocarbonyloxymethyl)-2-methyl-pentyl] N-butylcarbamateN-butylcarbamic acid [2-(carbamoyloxymethyl)-2-methyl-pentyl] esterCarbamic acid, N-butyl-, 2-[[(aminocarbonyl)oxy]methyl]-2-methylpentyl ester
Reposan4268-36-4W 713Tybamatum2-Methyl-2-propyltrimethylene butylcarbamate carbamateN-Butyl-2-methyl-2-propyl-1,3-propanediol dicarbamate2-(Hydroxymethyl)-2-methylpentyl butylcarbamate carbamateCarbamic acid, butyl-, 2-(((aminocarbonyl)oxy)methyl)-2-methylpentyl ester

データベース識別子

CAS
4268-36-4
PubChem CID
20266
DTXSID
DTXSID7023728
ChEMBL
CHEMBL2104816
ChEBI
CHEBI:135133
UNII
3875LLL8M8
EC Number
224-254-9
Nikkaji
J8.698C

物性

構造計算による物性

XLogP
2.4
極性表面積
90.7 Ų
水素結合供与体数
2
水素結合受容体数
4
回転可能結合数
11
重原子数
19
形式電荷
0
複雑度
284

実験および物理化学的性質

DrugsDEA NFLIS-Drug Category -> Depressants and Tranquilizers
OdorMILD CHARACTERISTIC ODOR
TasteBITTER TASTE
Color/Form · 2 件

CRYSTALS FROM 1,1,2-TRICHLOROETHANE + HEXANE (1:2)

WHITE CRYSTALLINE POWDER OR CLEAR, VISCOUS LIQ WHICH MAY CONGEAL TO SOLID ON STANDING

SolubilityVERY SOL IN ALC & ACETONE; FREELY SOL IN ETHER; VERY SLIGHTLY SOL IN WATER
Boiling Point150-152 °C @ 0.06 MM HG
Melting Point49-51 °C
Stability/Shelf LifeSTABLE IN LIGHT & HEAT

物理化学的性質

融点
49 · 49-51°
沸点
0.06 · bp0.06 150-152°
比重(密度)
1.079 · 1.0790 (rough estimate)
屈折率
1.4365 · 1.4365 (estimate)
酸解離定数(Pka)
12.8 · 12.80±0.46(Predicted)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

毒性情報

Interactions · 2 件

CONCURRENT INGESTION OF MEPROBAMATE & ALCOHOL CAN LEAD TO ENHANCEMENT OF THEIR CNS DEPRESSANT EFFECTS. ...TYBAMATE /IS/...CHEMICALLY & PHARMACOLOGICALLY RELATED TO MEPROBAMATE...

GRAND MAL OR PETIT MAL CONVULSIONS HAVE BEEN REPORTED IN FEW HOSPITALIZED PSYCHOTIC PT WHO RECEIVED LARGE DOSES OF TYBAMATE & PHENOTHIAZINES CONCOMITANTLY.

Human Toxicity Excerpts · 5 件

ACUTE NONTHROMBOCYTOPENIC PURPURA HAS ALSO BEEN REPORTED, & ANGIOEDEMA & BRONCHOSPASM HAVE OCCASIONALLY OCCURRED. ...ASSOC WITH DEVELOPMENT OF APLASTIC ANEMIA, THROMBOCYTOPENIA, LEUKOPENIA, AGRANULOCYTOSIS, & ERYTHROID HYPOPLASIA; NUMBER OF REPORTED CASES HAS BEEN VERY SMALL. /MEPROBAMATE/

MAJOR SIDE EFFECTS...ARE SLEEPINESS & ATAXIA, HYPOTENSION MAY OCCUR. ALLERGIC REACTIONS HAVE BEEN REPORTED IN FROM 0.2-3.4% OF DIFFERENT SERIES OF PT & APPEAR MOST FREQUENTLY IN THOSE WITH HISTORY OF DERMATOLOGICAL OR ALLERGIC CONDITIONS. URTICARIA OR ERYTHEMATOUS RASH IS MOST COMMON MANIFESTATION. /MEPROBAMATE/

EXACERBATION OF ACUTE INTERMITTENT PORPHYRIA...MAY BE CAUSED... SUICIDE ATTEMPTS...ARE NOT UNCOMMON. ... COMA, LOW BLOOD PRESSURE, SHOCK, PULMONARY EDEMA, & RESPIRATORY DEPRESSION CHARACTERIZE MASSIVE OVERDOSAGE. /MEPROBAMATE/

...GLOSSITIS...PRURITUS ANI...CONFUSION, DEPERSONALIZATION, & "PANIC REACTION" OCCUR OCCASIONALLY.

...DIZZINESS, SLURRED SPEECH, HEADACHE, VERTIGO, WEAKNESS, PARESTHESIAS, IMPAIRED VISUAL ACCOMMODATION, EUPHORIA, OVER-STIMULATION & PARADOXICAL EXCITEMENT...NAUSEA, VOMITING, & DIARRHEA...PALPITATION, ARRHYTHMIAS, SYNCOPE, & HYPOTENSIVE CRISES... /MEPROBAMATE/

安全データ

有毒物質データの
4268-36-4(Hazardous Substances Data)

化学と産業

薬理情報

Biological Half-Life...TYBAMATE...HAS T/2 OF 3 HR... BRIEF ACTION OF TYBAMATE IS ADVANTAGE IN SOME SITUATIONS.
MeSH Pharmacological Classification · 3 件

Compounds capable of relieving pain without the loss of CONSCIOUSNESS.

Agents that inhibit the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the MUSCARINIC ANTAGONISTS.

Drugs used to cause dilation of the blood vessels.

Absorption, Distribution and Excretion · 4 件

...WELL ABSORBED FROM GI TRACT... MEPROBAMATE IS QUITE UNIFORMLY DISTRIBUTED IN BODY, & ABOUT 10% OF DRUG IS EXCRETED IN UNCHANGED FORM IN URINE. /MEPROBAMATE/

ABSORPTION OF [(14)C]-TYBAMATE...FROM GI TRACT WAS FAIRLY RAPID IN RATS RECEIVING ORAL DOSE. 67% OF (14)C REMAINED THERE 2 HR LATER, WHEREAS ONLY 21% REMAINED 4 HR LATER. 21% WAS EXCRETED IN 2-HR URINE. 24 HR AFTER IP DOSE, RATS HAD EXCRETED 87% OF (14)C IN URINE, 5% IN FECES...3% WAS PRESENT IN INTESTINAL CONTENTS.

IN PREGNANT MICE, TYBAMATE SLOWLY CROSSED PLACENTA, & LEVELS OF (14)C WERE LOWER IN FETUS THAN IN MOTHER. 30 MIN AFTER RECTAL ADMIN...MUCH (14)C WAS PRESENT IN LIVER & INTESTINES. RAPID PENETRATION...INTO BRAIN & ADIPOSE TISSUE WOULD BE EXPECTED FOR THIS LIPID-SOL DRUG.

WHOLE-BODY AUTORADIOGRAPHY OF MICE RECEIVING IV DOSES...SHOWED THAT (14)C WAS PRESENT IN CNS WITHIN 50 SEC, & LEVELS WERE ALSO HIGH IN ADIPOSE TISSUE, MYOCARDIUM, SALIVARY GLANDS, & KIDNEYS. AFTER 10 MIN...(14)C IN BRAIN HAD DECR, BUT WERE HIGH IN LIVER, INTESTINES, & KIDNEYS, ORGANS CONCERNED WITH EXCRETION OF TYBAMATE.

用途と製造

UsesMEDICATION
Methods of ManufacturingPREPD FROM 2-METHYL-2-PROPYL-3-HYDROXYPROPYL CARBAMATE & BUTYL ISOCYANATE: BERGER, LUDWIG, US PATENT 2,937,119 (1960 TO CARTER PROD)
Formulations/Preparations · 2 件

TYBAMATE (SOLACEN, TYBATRAN), 125, 250, 350 MG CAPSULES.

INJECTION USP: 400 MG/5 ML; ORAL SUSPENSION NF: 200 MG/5 ML; TABLETS USP: 200 & 400 MG.

応用分野

使用Tranquilizer (minor).

サプライヤー3 社

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杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]

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