5-(6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pentanamide
Chemical Structure Depiction of
5-(6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pentanamide
5-(6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pentanamide
Compound characteristics
| Compound ID: | C200-8276 |
| Compound Name: | 5-(6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pentanamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | COc1cc2C(N(CCCCC(NCc3ccc(cc3)SC)=O)C(Nc2cc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7962 |
| logD: | 2.78 |
| logSw: | -3.4837 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.191 |
| InChI Key: | KKKCRIZCTKFZRW-UHFFFAOYSA-N |