기본 정보
- CAS
494219-55-5- 표준 SMILES
CCOC(=O)C1=C(C)NC(=S)NC1c1cn(CC)nc1C- InChIKey
FVAWORGLPOWXTG-UHFFFAOYSA-N- 분자식
- C14H20N4O2S
- 평균 분자량
- 308.4 g/mol
- 단동위원소 질량
- 308.13069707
이름 및 식별자
- 우선 이름
- ethyl 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
- IUPAC
- ethyl 4-(1-ethyl-3-methylpyrazol-4-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
- 영어명
- ethyl 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
- 분자식
- C14H20N4O2S
- 분자량
- 308.3992
이름 및 동의어
ethyl 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylateethyl 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylateSTK961549AKOS003750990ethyl 4-(1-ethyl-3-methylpyrazol-4-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylateST067597AK-968/41025073494219-55-5ethyl 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-thioxo-1,3,6-trihydropyrimid ine-5-carboxylate
데이터베이스 식별자
- CAS
494219-55-5- PubChem CID
- 4343732
물성
구조 계산 물성
- XLogP
- 1
- 극성 표면적
- 100 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 466
화학 및 산업
공급사1 곳
SPECS[email protected]
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