ethyl 2-[2-(4-tert-butylphenyl)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
기본 정보
- CAS
383372-68-7- 표준 SMILES
CCOC(=O)c1sc(N2C(=O)C(O)=C(C(=O)c3ccco3)C2c2ccc(C(C)(C)C)cc2)nc1C- InChIKey
UJWZGLKEPRSCEB-UHFFFAOYSA-N- 분자식
- C26H26N2O6S
- 평균 분자량
- 494.6 g/mol
이름 및 식별자
- 우선 이름
- ethyl 2-[2-(4-tert-butylphenyl)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 2-[2-(4-tert-butylphenyl)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
- 영어명
- ethyl 2-[2-(4-tert-butylphenyl)-3-(2-furoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
- 분자식
- C26H26N2O6S
- 분자량
- 494.56
이름 및 동의어
383372-68-7ethyl 2-[2-(4-tert-butylphenyl)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylateSTK896985STL149966AKOS001039751AKOS005749699AKOS016293005CCG-111274ethyl 2-[2-(4-tert-butylphenyl)-3-(furan-2-ylcarbonyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylateUPCMLD0ENAT0511-7092:001EU-0077561UNM000003557401
이름 더 보기
5-Thiazolecarboxylic acid, 2-[2-[4-(1,1-dimethylethyl)phenyl]-3-(2-furanylcarbonyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]-4-methyl-, ethyl ester
AF-399/41115102SR-01000487038SR-01000487038-1Z56864600ethyl 2-(2-(4-(tert-butyl)phenyl)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylateethyl 2-[2-(4-tert-butylphenyl)-3-(2-furoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylateethyl 2-{(3E)-2-(4-tert-butylphenyl)-3-[furan-2-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
데이터베이스 식별자
- CAS
383372-68-7
물성
구조 계산 물성
- XLogP
- 5.9
- 극성 표면적
- 138 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 876
물리화학적 성질
- 끓는 점
- 620.8 · 620.8±65.0 °C(Predicted)
- 밀도
- 1.333 · 1.333±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 4.5 · 4.50±1.00(Predicted)
관련 반응
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