1H-Pyrrolo[2,3-b]pyridine, 4-chloro-3-methyl-5-phenyl-1-(phenylsulfonyl)- (HCID 68761262)

기본 정보

표준 SMILES: Cc1cn(S(=O)(=O)c2ccccc2)c2ncc(-c3ccccc3)c(Cl)c12
InChIKey: PLFWQRHRIHBMQU-UHFFFAOYSA-N
분자식: C20H15ClN2O2S
평균 분자량: 382.9 g/mol

이름 및 식별자

우선 이름: 1H-Pyrrolo[2,3-b]pyridine, 4-chloro-3-methyl-5-phenyl-1-(phenylsulfonyl)-
IUPAC: 1-(benzenesulfonyl)-4-chloro-3-methyl-5-phenylpyrrolo[2,3-b]pyridine

이름 및 동의어

1172067-13-81H-Pyrrolo[2,3-b]pyridine, 4-chloro-3-methyl-5-phenyl-1-(phenylsulfonyl)-1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-methyl-5-phenyl-1-(phenylsulfonyl)-SCHEMBL3723150PLFWQRHRIHBMQU-UHFFFAOYSA-N4-Chloro-3-methyl-5-phenyl-1-(phenyl sulfonyl)-1H-pyrrolo[2,3-b]pyridine4-chloro-3-methyl-5-phenyl-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine4-Chloro-3-methyl-5-phenyl-1-(phenyl sulfonyl)-1H-pyrrolo [2,3-b]pyridine

데이터베이스 식별자

PubChem CID: 68761262

물성

구조 계산 물성

XLogP: 5.1
극성 표면적: 60.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 26
형식 전하: 0
복잡도: 581

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