AC1NRM3B
5-[[9-methyl-4-oxo-2-(3-propan-2-yloxypropylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-[[9-methyl-4-oxo-2-(3-propan-2-yloxypropylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one|9-Methyl-3-{[4-oxo-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-({3-[(propan-2-yl)oxy]propyl}amino)-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C22H28N4O3S2 |
|---|---|
| Molecular Weight | 460.16028 g/mol |
| LogP | 3.83952 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 460.16028 |
| Monoisotopic Mass | 460.16028 |
| Heavy Atoms | 31 |
| Complexity | 1092.0879 |
Chemical Identifiers
| CAS Number | 4862-40-2 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C)NCCCOC(C)C |
Product Overview
AC1NRM3B (CAS 4862-40-2), with molecular formula C22H28N4O3S2 and molecular weight 460.16028 g/mol. IUPAC: 5-[[9-methyl-4-oxo-2-(3-propan-2-yloxypropylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one.
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