2-[7-chloro-3-(3-methoxyphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[7-chloro-3-(3-methoxyphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
2-[7-chloro-3-(3-methoxyphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | V030-0120 |
| Compound Name: | 2-[7-chloro-3-(3-methoxyphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide |
| Molecular Weight: | 517.89 |
| Molecular Formula: | C25 H19 Cl F3 N3 O4 |
| Smiles: | COc1cccc(c1)N1C(c2ccc(cc2N(CC(NCc2cccc(c2)C(F)(F)F)=O)C1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3747 |
| logD: | 4.3747 |
| logSw: | -4.6543 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.671 |
| InChI Key: | WLVAAPZFLCBYCX-UHFFFAOYSA-N |