ChemDiv3_012526
N-(2-methylcyclohexyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide
Also Known As: ChemDiv3_012526|Oprea1_335624|SR-01000557416-1|BRD-A06744391-001-01-9|F0913-3424|N-(2-methylcyclohexyl)-4-oxo-3-(3-(2-oxopyrrolidin-1-yl)propyl)-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide|N-(2-methylcyclohexyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide|N-(2-methylcyclohexyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide
| Molecular Formula | C23H30N4O3S |
|---|---|
| Molecular Weight | 442.20386 g/mol |
| LogP | 3.38009 |
| Topological Polar Surface Area | 87.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.20386 |
| Monoisotopic Mass | 442.20386 |
| Heavy Atoms | 31 |
| Complexity | 1106.1741 |
Chemical Identifiers
| CAS Number | 443349-79-9 |
|---|---|
| SMILES | CC1CCCCC1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCCN4CCCC4=O |
Product Overview
ChemDiv3_012526 (CAS 443349-79-9), with molecular formula C23H30N4O3S and molecular weight 442.20386 g/mol. IUPAC: N-(2-methylcyclohexyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide.
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