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Dyclonine

HCID 3180
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
586-60-7
표준 SMILES
CCCCOc1ccc(C(=O)CCN2CCCCC2)cc1
InChIKey
BZEWSEKUUPWQDQ-UHFFFAOYSA-N
분자식
C18H27NO2
평균 분자량
289.4 g/mol
단동위원소 질량
289.2041791

개요

Dyclonine is N-Ethylpiperidine in which one of the hydrogens attached to the methyl group is substituted by a 4-butoxybenzoyl group. It has a role as a topical anaesthetic. It is a member of piperidines and an aromatic ketone.

이름 및 식별자

우선 이름
Dyclonine
IUPAC
1-(4-butoxyphenyl)-3-piperidin-1-ylpropan-1-one
영어명
DYCLONINE
분자식
C18H27NO2
분자량
289.41

이름 및 동의어

dyclonineDyclocaine586-60-7DicloninaDycloninum1-(4-butoxyphenyl)-3-(piperidin-1-yl)propan-1-one4'-Butoxy-3-piperidinopropiophenone3-Piperidino-4'-butoxypropiophenone2-(1-piperidyl)ethyl p-butoxyphenyl ketone4-butoxy-beta-piperidinopropiophenone1-(4-Butoxyphenyl)-3-(1-piperidinyl)-1-propanone4-n-butoxy-beta-(1-piperidyl)propiophenone
이름 더 보기
ycloninedycloninDacronineDyclonine HCIDYCLONINE USP/EP/BP4'-Butoxy-β-piperidinopropiophenone
078A24Q30OCHEBI:4724DTXSID60478641-propanone, 1-(4-butoxyphenyl)-3-(1-piperidinyl)1-Propanone,1-(4-butoxyphenyl)-3-(1-piperidinyl)-RefChem:55082DTXCID6027840N01BX02

데이터베이스 식별자

CAS
586-60-7
PubChem CID
3180
DTXSID
DTXSID6047864
ChEMBL
CHEMBL1201217

물성

구조 계산 물성

XLogP
3.6
극성 표면적
29.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
8
무거운 원자 수
21
형식 전하
0
복잡도
292

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15
LogP3.7
Solubility · 2건

Soluble (HCl salt)

4.60e-02 g/L

Human Drugs · 2건

Breast Feeding; Lactation; Anesthetics, Local

Pharmaceuticals

Endocrine DisruptorsPotential endocrine disrupting compound
Melting Point174-175
Physical DescriptionSolid
Dissociation Constants9
Collision Cross Section178.11 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

끓는 점
424.5 · 424.5±25.0 °C(Predicted)
밀도
1.017 · 1.017±0.06 g/cm3(Predicted)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

독성 정보

Effects During Pregnancy and Lactation◉ Summary of Use during Lactation

화학 및 산업

약리 정보

ATC Code · 4건

N - Nervous system

R - Respiratory system

QR - Respiratory system

QN - Nervous system

Pharmacodynamics · 1건

Dyclonine is an oral anasthetic. If substantial quantities of local anesthetics are absorbed through the mucosa, actions on the central nervous system (CNS) may cause CNS stimulation and/or CNS depression. Actions on the cardiovascular system may cause depression of cardiac conduction and excitability and, with some of these agents, peripheral vasodilation.

Mechanism of Action · 1건

Local anesthetics block both the initiation and conduction of nerve impulses by decreasing the neuronal membrane's permeability to sodium ions. This reversibly stabilizes the membrane and inhibits depolarization, resulting in the failure of a propagated action potential and subsequent conduction blockade.

Biological Half-LifeApproximately 30 to 60 minutes.
MeSH Pharmacological Classification · 1건

Drugs that block nerve conduction when applied locally to nerve tissue in appropriate concentrations. They act on any part of the nervous system and on every type of nerve fiber. In contact with a nerve trunk, these anesthetics can cause both sensory and motor paralysis in the innervated area. Their action is completely reversible. (From Gilman AG, et. al., Goodman and Gilman's The Pharmacological Basis of Therapeutics, 8th ed) Nearly all local anesthetics act by reducing the tendency of voltage-dependent sodium channels to activate.

Absorption, Distribution and Excretion · 1건

Readily absorbed through mucous membranes into the systemic circulation. The rate of absorption is influenced by the vascularity or rate of blood flow at the site of application, the total dosage (concentration and volume) administered, and the duration of exposure. Absorption from mucous membranes of the throat or respiratory tract may be especially rapid.

Cellular Locations

관련 반응

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화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
ChEBI
CHEBI:4724
UNII
078A24Q30O
Nikkaji
J6.738E
산도 계수 (pKa)
8.68 · 8.68±0.10(Predicted)
Extracellular

용도 및 제조

Use ClassificationPharmaceuticals

응용 분야

용도anesthetic (local)

상·하류 제품 정보

상류 원료

염산피페리딘염산염Para-포름알데하이드

공급사54 곳

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추가 설명

정의ChEBI: N-Ethylpiperidine in which one of the hydrogens attached to the methyl group is substituted by a 4-butoxybenzoyl group.