2-{[(4-methylphenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(4-methylphenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[(4-methylphenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G836-0442 |
| Compound Name: | 2-{[(4-methylphenyl)methyl]sulfanyl}-N,3-bis(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C25 H31 N3 O2 S |
| Smiles: | CC(C)CNC(c1ccc2C(N(CC(C)C)C(=Nc2c1)SCc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9559 |
| logD: | 4.9559 |
| logSw: | -4.4648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.727 |
| InChI Key: | FNRNIDAFSYIISI-UHFFFAOYSA-N |