N-cyclohexyl-4-oxo-3-(2-phenylethyl)-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-4-oxo-3-(2-phenylethyl)-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
N-cyclohexyl-4-oxo-3-(2-phenylethyl)-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0015957 |
| Compound Name: | N-cyclohexyl-4-oxo-3-(2-phenylethyl)-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 498.65 |
| Molecular Formula: | C29 H30 N4 O2 S |
| Smiles: | C1CCC(CC1)NC(c1ccc2C(N(CCc3ccccc3)C(=Nc2c1)SCc1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3832 |
| logD: | 4.3761 |
| logSw: | -4.2721 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.316 |
| InChI Key: | COKCJPQYGRXNRJ-UHFFFAOYSA-N |