디베나민

N-(2-Chloroethyl)dibenzylamine

HCID 5820CAS 51-50-3

기본 정보

표준 SMILES
ClCCN(Cc1ccccc1)Cc1ccccc1
InChIKey
GSLWSSUWNCJILM-UHFFFAOYSA-N
분자식
C16H18ClN
평균 분자량
259.77 g/mol
단동위원소 질량
259.11277726

이름 및 식별자

우선 이름
N-(2-Chloroethyl)dibenzylamine
IUPAC
N,N-dibenzyl-2-chloroethanamine
현지명
디베나민
영어명
Dibenamine
분자식
C16H18ClN
분자량
259.77

이름 및 동의어

DIBENAMINE51-50-3N-(2-Chloroethyl)dibenzylamineN,N-Dibenzyl-2-chloroethanamine2-(Dibenzylamino)ethyl chlorideDibenzylchlorethylamine2-ChloroethyldibenzylamineSKF 199Dibenzylamine, N-(2-chloroethyl)-N,N-Dibenzyl-2-chloroethylamineN,N-Dibenzyl-beta-chloroethylamine43EXU2S56H
이름 더 보기
디베나민N,N-Dibenzyl-2-chloroethan-1-amine(2-Chloroethyl)dibenzylaminebis(benzyl)-(2-chloroethyl)amine2-chloro-N,N-bis(phenylmethyl)ethanamine
DTXSID20199001Benzenemethanamine, N-(2-chloroethyl)-N-(phenylmethyl)-RefChem:388925DTXCID10121492DibenzylchlorethamineDibenzyl chlorethylamineDibenzyl(2-chloroethyl)amineN,N-Dibenzyl-.beta.-chloroethylamine

데이터베이스 식별자

CAS
51-50-3
PubChem CID
5820
DTXSID
DTXSID20199001
ChEMBL
CHEMBL3305685
UNII
43EXU2S56H
Nikkaji
J10.688G

물성

구조 계산 물성

XLogP
3.8
극성 표면적
3.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
6
무거운 원자 수
18

실험 및 물리화학적 성질

Color/FormOILY LIQUID
Stability/Shelf Life · 2건

TURNS YELLOW ON STORAGE & DECOMP ON STANDING TO FORM SOLID POLYMERIC COMPD /CHLOROETHYLAMINES/

STABLE IN ACID SOLN BUT RAPIDLY LOSES ACTIVITY IN NEUTRAL OR ALKALINE AQ SOLUTIONS /HYDROCHLORIDE/

Other Experimental Properties · 2건

MP: 192 °C, ALSO GIVEN AS 180-181 °C; PRACTICALLY INSOL IN H2O NEAR NEUTRALITY; SOLUBLE IN DIL ACID: 2% @ PH 2.1, 1% @ PH 2.4, 0.5% @ PH 2.74; SOL IN 95% ALCOHOL, PROPYLENE GLYCOL /HYDROCHLORIDE/

COLORLESS CRYSTALLINE SOLID /CHLOROETHYLAMINE HYDROCHLORIDE/

물리화학적 성질

녹는점
192 °C · 192 °C
끓는 점
407.11 °C · 407.11°C (rough estimate)
밀도
1.0738 · 1.0738 (rough estimate)
굴절률
1.6 · 1.6000 (estimate)
산도 계수 (pKa)
6.5 · 6.50±0.50(Predicted)

안전 및 규제

독성 정보

Interactions · 5건

...ATROPINE APPEARS TO ANTAGONIZE ACTION OF DIBENAMINE OR "DEBLOCK".

REDN IN PRESSOR RESPONSE WITHOUT REVERSAL IS USUALLY SEEN WHEN CAPACITY FOR ADRENERGIC VASODILATATION IS LIMITED BY ANY FACTOR, FOR EXAMPLE, SYMPATHOMIMETIC AMINE USED (NOREPINEPHRINE, PHENYLEPHRINE, OR OTHER AGENTS WITH MINIMAL BETA-ADRENERGIC AGONISTIC ACTIVITY) OF PREPN EMPLOYED...

FORMATION OF 7% FORMALADHYDE INDUCED SC GRANULOMA WAS GREATLY SUPPRESSED BY EPINEPHRINE & SLIGHTLY BY NOREPINEPHRINE. DIBENAMINE WAS A WEAKER EXPTL GRANULOMA SUPPRESSOR.

CENTRAL EFFECTS OF SOME ADRENOLYTICS ON SPONTANEOUS MOTILITY & ON POTENTIATION OF SUBHYPNOTIC DOSES OF SODIUM PENTOBARBITAL WERE STUDIED IN MICE. DIBENAMINE POTENTIATED THE ACTION OF SODIUM PENTOBARBITAL. ALL DRUGS, EXCEPT BRETYLIUM DECR SPONTANEOUS MOTILITY.

For more Interactions (Complete) data for DIBENAMINE (9 total), please visit the HSDB record page.

Human Toxicity Excerpts · 3건

DIBENAMINE.../STIMULATES/ CNS TO CAUSE NAUSEA, VOMITING, HYPERVENTILATION, MOTOR EXCITABILITY...CONVULSIONS, PARTICULARLY WHEN RELATIVELY LARGE DOSE IS RAPIDLY INJECTED IV. IN MAN, CHARACTERISTIC LOSS OF TIME PERCEPTION MAY OCCUR.

LOSS OF VASOMOTOR CONTROL CAN RESULT IN POSTURAL HYPOTENSION & REFLEX TACHYCARDIA IN AMBULATORY PATIENTS, OR A SHARP FALL IN BLOOD PRESSURE IN THOSE WHO ARE HYPOVOLEMIC. /ALPHA-ADRENERGIC BLOCKING AGENTS/

OTHER RESULTS OF ALPHA-RECEPTOR BLOCKADE INCL MIOSIS, NASAL STUFFINESS, & INHIBITION OF EJACULATION. /ALPHA-ADRENERGIC BLOCKING AGENTS/

Non-Human Toxicity Excerpts · 2건

...TACHYCARDIA IN INTACT ANIMALS IS USUALLY EXAGGERATED BECAUSE PRESSOR RESPONSE IS PREVENTED & REFLEX VAGAL STIMULATION IS MINIMIZED. ...DIBENAMINE INDUCE/S/ REFLEX TACHYCARDIA...

BOVINE BRAIN SODIUM-POTASSIUM ACTIVATED ATPASE WAS IRREVERSIBLY INHIBITED BY DIBENAMINE & DIBENAMINE ANALOGS WHICH ARE ADRENERGIC ALPHA-BLOCKERS.

안전 데이터

유해 물질 데이터
51-50-3(Hazardous Substances Data)

화학 및 산업

약리 정보

Mechanism of Action · 2건

ALPHA-ADRENERGIC BLOCKING AGENTS BIND SELECTIVELY TO ALPHA CLASS OF ADRENERGIC RECEPTORS & THEREBY INTERFERE WITH CAPACITY OF SYMPATHOMIMETIC AMINES TO INITIATE ACTIONS AT THESE SITES. ...DIBENAMINE BIND/S/ COVALENTLY TO ALPHA RECEPTOR & PRODUCE/S/ IRREVERSIBLE & INSURMOUNTABLE TYPE OF BLOCKADE.

...DIBENAMINE HAS RELATIVELY LOW ANTIHISTAMINIC ACTIVITY...

MeSH Pharmacological Classification · 2건

Drugs that bind to but do not activate alpha-adrenergic receptors thereby blocking the actions of endogenous or exogenous adrenergic agonists. Adrenergic alpha-antagonists are used in the treatment of hypertension, vasospasm, peripheral vascular disease, shock, and pheochromocytoma.

Drugs that inhibit the actions of the sympathetic nervous system by any mechanism. The most common of these are the ADRENERGIC ANTAGONISTS and drugs that deplete norepinephrine or reduce the release of transmitters from adrenergic postganglionic terminals (see ADRENERGIC AGENTS). Drugs that act in the central nervous system to reduce sympathetic activity (e.g., centrally acting alpha-2 adrenergic agonists, see ADRENERGIC ALPHA-AGONISTS) are included here.

Absorption, Distribution and ExcretionABSORPTION FROM GI TRACT IS INCOMPLETE & SOMEWHAT CAPRICIOUS... THE METABOLIC FATE OF THESE HIGHLY UNSTABLE AGENTS IS POORLY UNDERSTOOD. /HALOALKYLAMINE ADRENERGIC BLOCKING AGENTS/

용도 및 제조

UsesMEDICATION
Methods of Manufacturing · 2건

CHLOROETHYLAMINES ARE PREPARED BY ACTION OF THIONYL CHLORIDE ON APPROPRIATE ETHANOLAMINE... FREE BASE IS LIBERATED BY TREATING HYDROCHLORIDE WITH SODIUM HYDROXIDE OR CARBONATE.

RABALD, DIMROTH, GERMAN PATENT 824,208 (1951 TO CF BOEHRINGER, MANN); CA 47, 2206 (1953). /HYDROCHLORIDE/

공급사3 곳

上海之坤生物科技有限公司15821335126 15821335126 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]

관련 반응

12건

연결된 노트

불러오는 중…