2-[3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
2-[3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | V029-9327 |
| Compound Name: | 2-[3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide |
| Molecular Weight: | 498.42 |
| Molecular Formula: | C24 H17 F3 N4 O5 |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)C(F)(F)F)NC(CN1C(N(C(c2ccccc12)=O)c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1537 |
| logD: | 3.1537 |
| logSw: | -3.784 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.508 |
| InChI Key: | CBCHXEZTSNTPBA-UHFFFAOYSA-N |