N-[(3-chlorophenyl)methyl]-4-oxo-3-pentyl-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-4-oxo-3-pentyl-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
N-[(3-chlorophenyl)methyl]-4-oxo-3-pentyl-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0016354 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-4-oxo-3-pentyl-2-{[(pyridin-4-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 507.05 |
| Molecular Formula: | C27 H27 Cl N4 O2 S |
| Smiles: | CCCCCN1C(=Nc2cc(ccc2C1=O)C(NCc1cccc(c1)[Cl])=O)SCc1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9578 |
| logD: | 4.9506 |
| logSw: | -4.9459 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.862 |
| InChI Key: | DOBGPOLAGUDEOG-UHFFFAOYSA-N |