2-chloro-N-({2-[1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethyl]-1,3-dioxoisoindolin-4-yl}methyl)acetamide

HCID 18758380

기본 정보

표준 SMILES
CCOc1cc(C(CS(C)(=O)=O)N2C(=O)c3cccc(CNC(=O)CCl)c3C2=O)ccc1OC
InChIKey
ISODCLUTRNLGQU-UHFFFAOYSA-N
분자식
C23H25ClN2O7S
평균 분자량
509 g/mol

이름 및 식별자

우선 이름
2-chloro-N-({2-[1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethyl]-1,3-dioxoisoindolin-4-yl}methyl)acetamide
IUPAC
2-chloro-N-[[2-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1,3-dioxoisoindol-4-yl]methyl]acetamide

이름 및 동의어

2-chloro-N-({2-(1-(3ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethyl]-1,3-dioxoisoindolin-4-yl}methyl)acetamide2-chloro-N-({2-[1-(3ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethyl]-1,3-dioxoisoindolin-4-yl}methyl)acetamideSCHEMBL537201ISODCLUTRNLGQU-UHFFFAOYSA-N2-chloro-N-({2-[1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethyl]-1,3-dioxoisoindolin-4-yl}methyl)acetamide

데이터베이스 식별자

PubChem CID
18758380

물성

구조 계산 물성

XLogP
1.8
극성 표면적
127 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
10
무거운 원자 수
34

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