2-((R)-9-((S)-1-(4-chlorophenyl)ethyl)-6-fluoro-8-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetic acid

HCID 11259797
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
C[C@@H](c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O
InChIKey
SSLHBZFYMFYOLS-DZGCQCFKSA-N
분자식
C23H23ClFNO4S
평균 분자량
463.9 g/mol

이름 및 식별자

우선 이름
2-((R)-9-((S)-1-(4-chlorophenyl)ethyl)-6-fluoro-8-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetic acid
IUPAC
2-[(1R)-9-[(1S)-1-(4-chlorophenyl)ethyl]-6-fluoro-8-methylsulfonyl-1,2,3,4-tetrahydrocarbazol-1-yl]acetic acid

이름 및 동의어

CHEMBL1290079SCHEMBL1255151SSLHBZFYMFYOLS-DZGCQCFKSA-NBDBM50331731[(1R)-9-[(1S)-1-(4-chlorophenyl)ethyl]-6-fluoro-8-(methyl-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetic acid[(1R)-9-[(1S)-1-(4-chlorophenyl)ethyl]-6-fluoro-8-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetic acid2-((R)-9-((S)-1-(4-chlorophenyl)ethyl)-6-fluoro-8-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetic acid

데이터베이스 식별자

PubChem CID
11259797
ChEMBL
CHEMBL1290079

물성

구조 계산 물성

XLogP
4.5
극성 표면적
84.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
5
무거운 원자 수
31

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