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기본 정보
- 표준 SMILES
Cc1cccc(-c2sc(C)nc2C(=O)N2[C@H](CNC(=O)c3c(C)nc4sccn34)C[C@@H]3C[C@@H]32)c1- InChIKey
BBILWLLJFSWYFO-QYZOEREBSA-N- 분자식
- C25H25N5O2S2
- 평균 분자량
- 491.6 g/mol
이름 및 식별자
- 우선 이름
- Imidazo[2,1-b]thiazole-5-carboxamide,6-methyl-N-[[(1S,3S,5S)-2-[[2-methyl-5-(3-methylphenyl)-4-thiazolyl]carbonyl]-2-azabicyclo[3.1.0]hex-3-yl]Methyl]-
- IUPAC
- 6-methyl-N-[[(1S,3S,5S)-2-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-2-azabicyclo[3.1.0]hexan-3-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
이름 및 동의어
1038505-88-2CHEMBL509417Imidazo[2,1-b]thiazole-5-carboxamide,6-methyl-N-[[(1S,3S,5S)-2-[[2-methyl-5-(3-methylphenyl)-4-thiazolyl]carbonyl]-2-azabicyclo[3.1.0]hex-3-yl]Methyl]-Imidazo[2,1-b]thiazole-5-carboxamide, 6-methyl-N-[[(1S,3S,5S)-2-[[2-methyl-5-(3-methylphenyl)-4-thiazolyl]carbonyl]-2-azabicyclo[3.1.0]hex-3-yl]methyl]-SCHEMBL1571482BBILWLLJFSWYFO-QYZOEREBSA-NBDBM502929726-methyl-imidazo[2,1-b]thiazole-5-carboxylic acid [(1S,3S,5S)-2-(2-methyl-5-m-tolyl-thiazole-4-carbonyl)-2-aza-bicyclo[3.1.0]hex-3-ylmethyl]-amide6-methyl-N-(((1S,3S,5S)-2-(2-methyl-5-m-tolylthiazole-4-carbonyl)-2-azabicyclo[3.1.0]hexan-3-yl)methyl)imidazo[2,1-b]thiazole-5-carboxamide
데이터베이스 식별자
- PubChem CID
- 24853522
- ChEMBL
CHEMBL509417
물성
구조 계산 물성보충 중
- XLogP
- 5.5
- 극성 표면적
- 136 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 816
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