5-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-3-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-diethylamino-ethyl)-amide

HCID 69768389
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기본 정보

표준 SMILES
CCN(CC)CCNC(=O)c1cc(C)c(C=C2C(=O)Nc3cccc(-c4cccc(F)c4)c32)[nH]1
InChIKey
HVIPWBMWRSJICM-UHFFFAOYSA-N
분자식
C27H29FN4O2
평균 분자량
460.5 g/mol

이름 및 식별자

우선 이름
5-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-3-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-diethylamino-ethyl)-amide
IUPAC
N-[2-(diethylamino)ethyl]-5-[[4-(3-fluorophenyl)-2-oxo-1H-indol-3-ylidene]methyl]-4-methyl-1H-pyrrole-2-carboxamide

이름 및 동의어

SCHEMBL6404884HVIPWBMWRSJICM-UHFFFAOYSA-N5-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-3-ylidenemethyl]-4-methyl-1 H-pyrrole-2-carboxylic acid (2-diethylamino-ethyl)-amide5-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-3-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-diethylamino-ethyl)-amide5-[4-(3-fluoro-phenyl)2-oxo-1,2-dihydro-indol-3-ylidenemethyl]4-methyl-1H-pyrrole-2-carboxylic acid (2-diethylamino-ethyl)-amide

데이터베이스 식별자

PubChem CID
69768389

물성

구조 계산 물성

XLogP
4.2
극성 표면적
77.2 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
4
회전 가능 결합 수
8
무거운 원자 수
34

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