기본 정보
- CAS
312940-53-7- 표준 SMILES
CC(C)(CC(=O)Nc1sc2c(c1C(=O)O)CCC2)CC(=O)Nc1sc2c(c1C(=O)O)CCC2- InChIKey
RUPLTNGQLSTCDA-UHFFFAOYSA-N- 분자식
- C23H26N2O6S2
- 평균 분자량
- 490.6 g/mol
- 단동위원소 질량
- 490.1232289
이름 및 식별자
- 우선 이름
- 2-[[5-[(3-carboxy-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
- IUPAC
- 2-[[5-[(3-carboxy-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
- 영어명
- 2-({5-[(3-carboxy-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
- 분자식
- C23H26N2O6S2
- 분자량
- 490.59234
이름 및 동의어
Oprea1_808446AE-848/37236063AKOS0010292872-[[5-[(3-carboxy-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acidZ568001212,2'-[(3,3-dimethyl-1,5-dioxopentane-1,5-diyl)bis(azanediyl)]di(5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid)2,2'-[(3,3-dimethyl-1,5-dioxopentane-1,5-diyl)di(imino)]bis(5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid)2-({5-[(3-carboxy-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
데이터베이스 식별자
- CAS
312940-53-7- PubChem CID
- 1806301
물성
구조 계산 물성
- XLogP
- 4.6
- 극성 표면적
- 189 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 757
화학 및 산업
공급사1 곳
SPECS[email protected]
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