N-(3-chlorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide
N-(3-chlorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0015507 |
| Compound Name: | N-(3-chlorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 543 |
| Molecular Formula: | C28 H19 Cl N4 O4 S |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)SC1=Nc2cc(ccc2C(N1c1ccccc1)=O)C(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8225 |
| logD: | 5.8132 |
| logSw: | -5.9103 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.632 |
| InChI Key: | CLPJOTUNNSKLDJ-UHFFFAOYSA-N |