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

HCID 69740587

기본 정보

표준 SMILES
Cc1cc(C(=O)O)c(/C=C2\C(=O)Nc3cccc(-c4cccc(F)c4)c32)[nH]1
InChIKey
BPVXTQOTIJLDKF-YBEGLDIGSA-N
분자식
C21H15FN2O3
평균 분자량
362.4 g/mol

이름 및 식별자

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

이름 및 동의어

SCHEMBL6319360BPVXTQOTIJLDKF-YBEGLDIGSA-N2-[4-(3-Fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3-Z)-ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid2-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3Z) ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid2-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3Z)- ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid2-[4-(3-fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid

데이터베이스 식별자

PubChem CID
69740587

물성

구조 계산 물성

XLogP
3.4
극성 표면적
82.2 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
4
회전 가능 결합 수
3
무거운 원자 수
27

관련 반응

16건

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