기본 정보
- CAS
853753-21-6- 표준 SMILES
Cc1ccc(S(=O)(=O)c2cc3c(=O)n4cccc(C)c4nc3n(CC3CCCO3)c2=N)cc1C- InChIKey
CRSLXKSPYHQOKI-UHFFFAOYSA-N- 분자식
- C25H26N4O4S
- 평균 분자량
- 478.6 g/mol
이름 및 식별자
- 우선 이름
- 3-[(3,4-dimethylphenyl)sulfonyl]-2-imino-10-methyl-1-(tetrahydro-2-furanylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-one
- IUPAC
- 5-(3,4-dimethylphenyl)sulfonyl-6-imino-11-methyl-7-(oxolan-2-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
- 영어명
- 3-[(3,4-dimethylphenyl)sulfonyl]-2-imino-10-methyl-1-(tetrahydro-2-furanylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-one
- 분자식
- C25H26N4O4S
- 분자량
- 478.56
이름 및 동의어
853753-21-63-[(3,4-dimethylphenyl)sulfonyl]-2-imino-10-methyl-1-(tetrahydro-2-furanylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-oneMLS000333653CHEMBL1299976HMS2779D08STK931753AKOS002221803AKOS0163039965-(3,4-Dimethylphenyl)sulfonyl-6-imino-11-methyl-7-(oxolan-2-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-oneSMR000437722ST50119098AO-022/43453077
이름 더 보기
5H-Dipyrido[1,2-a:2',3'-d]pyrimidin-5-one, 3-[(3,4-dimethylphenyl)sulfonyl]-1,2-dihydro-2-imino-10-methyl-1-[(tetrahydro-2-furanyl)methyl]-
Z3360904143-((3,4-dimethylphenyl)sulfonyl)-2-imino-10-methyl-1-((tetrahydrofuran-2-yl)methyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one3-(3,4-Dimethyl-benzenesulfonyl)-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-t riaza-anthracen-10-one3-[(3,4-dimethylphenyl)sulfonyl]-2-imino-10-methyl-1-(oxolan-2-ylmethyl)-1,6-d ihydropyridino[2,3-d]pyridino[1,2-a]pyrimidin-5-one3-[(3,4-dimethylphenyl)sulfonyl]-2-imino-10-methyl-1-(tetrahydrofuran-2-ylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
물성
구조 계산 물성
- XLogP
- 2.5
- 극성 표면적
- 112 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 1,190
화학 및 산업
공급사4 곳
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