[4-[2-(5-Cyano-2-hydroxybenzenesulfonylamino)ethyl]-2'-methanesulfonyl-biphenyl-3-yloxy]acetic acid
기본 정보
- 표준 SMILES
CS(=O)(=O)c1ccccc1-c1ccc(CCNS(=O)(=O)c2cc(C#N)ccc2O)c(OCC(=O)O)c1- InChIKey
FTFGJLAGUJNLBO-UHFFFAOYSA-N- 분자식
- C24H22N2O8S2
- 평균 분자량
- 530.6 g/mol
이름 및 식별자
- 우선 이름
- [4-[2-(5-Cyano-2-hydroxybenzenesulfonylamino)ethyl]-2'-methanesulfonyl-biphenyl-3-yloxy]acetic acid
- IUPAC
- 2-[2-[2-[(5-cyano-2-hydroxyphenyl)sulfonylamino]ethyl]-5-(2-methylsulfonylphenyl)phenoxy]acetic acid
이름 및 동의어
[4-[2-(5-cyano-2-hydroxybenzenesulfonylamino)-ethyl]-2'-methanesulfonylbiphenyl-3-yloxy)acetic acid[4-[2-(5-cyano-2-hydroxybenzenesulfonylamino)-ethyl]-2'-methanesulfonylbiphenyl-3-yloxy]acetic acidSCHEMBL3881274FTFGJLAGUJNLBO-UHFFFAOYSA-N[4-[2-(5-cyano-2-hydroxybenzenesulfonylamino)ethyl]-2'-methanesulfonyl-biphenyl-3-yloxy]acetic acid[4-[2-(5-cyano-2-hydroxybenzenesulfonylamino)ethyl]-2'-methanesulfonylbiphenyl-3-yloxy]-acetic acid[4-[2-(5-cyano-2-hydroxybenzenesulfonylamino)ethyl]-2'-methanesulfonylbiphenyl-3-yloxy]acetic acid
데이터베이스 식별자
- PubChem CID
- 17856249
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 188 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 1,010
관련 반응
10건
화합물 노트
불러오는 중…