Allyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate
기본 정보
- CAS
431941-61-6- 표준 SMILES
C=CCOC(=O)C1=C(C)N=C2SCCC(=O)N2C1c1ccc(OC)c(OC)c1- InChIKey
MFJRBBBDDXPFKG-UHFFFAOYSA-N- 분자식
- C20H22N2O5S
- 평균 분자량
- 402.5 g/mol
이름 및 식별자
- 우선 이름
- Allyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate
- IUPAC
- prop-2-enyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
- 영어명
- allyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
- 분자식
- C20H22N2O5S
- 분자량
- 402.46
이름 및 동의어
431941-61-6allyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylateprop-2-en-1-yl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-2H,3H,4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylateprop-2-enyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylateSTK876994AKOS000526501AKOS016064456SR-01000491505SR-01000491505-1Z57239940F1260-1377prop-2-en-1-yl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
이름 더 보기
allyl 6-(3,4-dimethoxyphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate2H,6H-Pyrimido[2,1-b][1,3]thiazine-7-carboxylic acid, 6-(3,4-dimethoxyphenyl)-3,4-dihydro-8-methyl-4-oxo-, 2-propen-1-yl ester
데이터베이스 식별자
- CAS
431941-61-6
물성
구조 계산 물성
- XLogP
- 2.5
- 극성 표면적
- 103 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 705
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