N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide
N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Compound characteristics
| Compound ID: | K284-7485 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide |
| Molecular Weight: | 475.99 |
| Molecular Formula: | C23 H26 Cl N3 O4 S |
| Smiles: | CCOc1cc2C(N(CCCC(NCc3ccc(cc3)[Cl])=O)C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.815 |
| logD: | 2.7931 |
| logSw: | -3.6296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.188 |
| InChI Key: | PUPZMBMIZXEVMI-UHFFFAOYSA-N |