2-[3-(4-ethoxyphenyl)-6-methyl-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[3-(4-ethoxyphenyl)-6-methyl-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
2-[3-(4-ethoxyphenyl)-6-methyl-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | V027-3591 |
| Compound Name: | 2-[3-(4-ethoxyphenyl)-6-methyl-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide |
| Molecular Weight: | 511.5 |
| Molecular Formula: | C27 H24 F3 N3 O4 |
| Smiles: | CCOc1ccc(cc1)N1C(c2cc(C)ccc2N(CC(NCc2cccc(c2)C(F)(F)F)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2808 |
| logD: | 4.2808 |
| logSw: | -4.2871 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.25 |
| InChI Key: | MDKKQWJEBNXDJH-UHFFFAOYSA-N |