2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(2-methylpropyl)-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(2-methylpropyl)-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(2-methylpropyl)-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G836-0409 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(2-methylpropyl)-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 461.98 |
| Molecular Formula: | C23 H25 Cl F N3 O2 S |
| Smiles: | CC(C)CN1C(=Nc2cc(ccc2C1=O)C(NC(C)C)=O)SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 5.2785 |
| logD: | 5.2785 |
| logSw: | -5.6958 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.702 |
| InChI Key: | SUMNABXVTUVDQI-UHFFFAOYSA-N |