기본 정보
- CAS
438474-26-1- 표준 SMILES
CCOC(=O)c1c(NC(=O)c2cc(-c3ccc(C)cc3C)nc3ccccc23)sc(C(=O)N(CC)CC)c1C- InChIKey
JARIEZWBOBFTJQ-UHFFFAOYSA-N- 분자식
- C31H33N3O4S
- 평균 분자량
- 543.7 g/mol
- 단동위원소 질량
- 543.21917772
이름 및 식별자
- 우선 이름
- Ethyl 5-(diethylcarbamoyl)-2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-methylthiophene-3-carboxylate
- IUPAC
- ethyl 5-(diethylcarbamoyl)-2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-methylthiophene-3-carboxylate
- 영어명
- ethyl 5-[(diethylamino)carbonyl]-2-({[2-(2,4-dimethylphenyl)-4-quinolinyl]carbonyl}amino)-4-methyl-3-thiophenecarboxylate
- 분자식
- C31H33N3O4S
- 분자량
- 543.67642
이름 및 동의어
ethyl 5-(diethylcarbamoyl)-2-({[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-4-methylthiophene-3-carboxylateethyl 5-(diethylcarbamoyl)-2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-methylthiophene-3-carboxylateethyl 5-(diethylcarbamoyl)-2-{[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino}-4-methylthiophene-3-carboxylateOprea1_830594AK-968/15253246STK420882AKOS003285829ethyl 5-[(diethylamino)carbonyl]-2-({[2-(2,4-dimethylphenyl)-4-quinolinyl]carbonyl}amino)-4-methyl-3-thiophenecarboxylate
데이터베이스 식별자
- CAS
438474-26-1- PubChem CID
- 4207228
물성
구조 계산 물성
- XLogP
- 7.1
- 극성 표면적
- 117 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 867
화학 및 산업
공급사1 곳
SPECS[email protected]
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