기본 정보
- CAS
353769-44-5- 표준 SMILES
CCc1c(C)sc(NC(=O)c2cc(-c3ccc(C)c(C)c3)nc3ccccc23)c1C(=O)OC(C)C- InChIKey
JVUCUGMMULCAGX-UHFFFAOYSA-N- 분자식
- C29H30N2O3S
- 평균 분자량
- 486.6 g/mol
- 단동위원소 질량
- 486.197714
이름 및 식별자
- 우선 이름
- Isopropyl 2-({[2-(3,4-dimethylphenyl)-4-quinolinyl]carbonyl}amino)-4-ethyl-5-methyl-3-thiophenecarboxylate
- IUPAC
- propan-2-yl 2-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate
- 영어명
- isopropyl 2-({[2-(3,4-dimethylphenyl)-4-quinolinyl]carbonyl}amino)-4-ethyl-5-methyl-3-thiophenecarboxylate
- 분자식
- C29H30N2O3S
- 분자량
- 486.6251
이름 및 동의어
isopropyl 2-({[2-(3,4-dimethylphenyl)-4-quinolinyl]carbonyl}amino)-4-ethyl-5-methyl-3-thiophenecarboxylateAK-968/13030084STK437453AKOS003278028propan-2-yl 2-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-ethyl-5-methylthiophene-3-carboxylateST50924836methylethyl 2-{[2-(3,4-dimethylphenyl)(4-quinolyl)]carbonylamino}-4-ethyl-5-me thylthiophene-3-carboxylatepropan-2-yl 2-({[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-4-ethyl-5-methylthiophene-3-carboxylate
데이터베이스 식별자
- CAS
353769-44-5- PubChem CID
- 1744695
물성
구조 계산 물성
- XLogP
- 7.8
- 극성 표면적
- 96.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 745
화학 및 산업
공급사1 곳
SPECS[email protected]
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