기본 정보
- CAS
68256-07-5- 표준 SMILES
CCN1CCCC1CNC(=O)c1cc(NS(C)(=O)=O)c(C)cc1OC- InChIKey
YTRPYXNQCLTHGY-UHFFFAOYSA-N- 분자식
- C17H27N3O4S
- 평균 분자량
- 369.5 g/mol
- 단동위원소 질량
- 369.17222752
이름 및 식별자
- 우선 이름
- Benzamide, N-((1-ethyl-2-pyrrolidinyl)methyl)-2-methoxy-4-methyl-5-((methylsulfonyl)amino)-
- IUPAC
- N-[(1-ethylpyrrolidin-2-yl)methyl]-5-(methanesulfonamido)-2-methoxy-4-methylbenzamide
이름 및 동의어
68256-07-5BRN 0447913Benzamide, N-((1-ethyl-2-pyrrolidinyl)methyl)-2-methoxy-4-methyl-5-((methylsulfonyl)amino)-N-((1-Ethyl-2-pyrrolidinyl)methyl)-2-methoxy-4-methyl-5-methanesulfonamidobenzamideRefChem:322018N-((1-Ethylpyrrolidin-2-yl)methyl)-2-methoxy-4-methyl-5-(methylsulfonamido)benzamideCHEMBL14479SCHEMBL11079730DTXSID10987777YTRPYXNQCLTHGY-UHFFFAOYSA-NN-(1-ethyl-2-pyrrolidinylmethyl)-2-methoxy-4-methyl-5-methanesulfonamidobenzamideN-[(1-Ethylpyrrolidin-2-yl)methyl]-5-(methanesulfonamido)-2-methoxy-4-methylbenzene-1-carboximidic acid
이름 더 보기
N-[(1-Ethylpyrrolidin-2-yl)methyl]-5-[(methanesulfonyl)amino]-2-methoxy-4-methylbenzene-1-carboximidic acid
데이터베이스 식별자
- CAS
68256-07-5- PubChem CID
- 50115
- DTXSID
DTXSID10987777
물성
구조 계산 물성
- XLogP
- 1.3
- 극성 표면적
- 96.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 549
관련 반응
7건
화합물 노트
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