1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-ethyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-

HCID 212929

기본 정보

CAS
102207-58-9
표준 SMILES
CCN1CCc2c(c3cc(C)ccc3n2CCc2ccc(C)nc2)C1
InChIKey
ISWGLGLPSQCQIO-UHFFFAOYSA-N
분자식
C22H27N3
평균 분자량
333.5 g/mol
단동위원소 질량
333.22049787

이름 및 식별자

우선 이름
1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-ethyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-
IUPAC
2-ethyl-8-methyl-5-[2-(6-methyl-3-pyridinyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indole

이름 및 동의어

EmelineEmelin1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-ethyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-2,3,4,5-Tetrahydro-2-ethyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-1H-pyrido(4,3-b)indoleDTXSID90144785RefChem:240265DTXCID4067276102207-58-9SCHEMBL3715001ISWGLGLPSQCQIO-UHFFFAOYSA-N2-ethyl-8-methyl-5-[2-(6-methylpyridin-3-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole2-ethyl-2,3,4,5-tetrahydro-8-methyl-5-(2-(6-methylpyridin-3-yl)ethyl)-1H-pyrido[4,3-b]indole

데이터베이스 식별자

CAS
102207-58-9
PubChem CID
212929
DTXSID
DTXSID90144785
Nikkaji
J85.832C

물성

구조 계산 물성

XLogP
3.9
극성 표면적
21.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
4
무거운 원자 수
25

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