7,7-dimethyl-2-[3-(trifluoromethyl)anilino]-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
7,7-dimethyl-2-[3-(trifluoromethyl)anilino]-7,8-dihydroquinazolin-5(6H)-one
7,7-dimethyl-2-[3-(trifluoromethyl)anilino]-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | D367-0465 |
| Compound Name: | 7,7-dimethyl-2-[3-(trifluoromethyl)anilino]-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 335.33 |
| Molecular Formula: | C17 H16 F3 N3 O |
| Smiles: | CC1(C)CC(c2cnc(Nc3cccc(c3)C(F)(F)F)nc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1723 |
| logD: | 4.1723 |
| logSw: | -4.3111 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.047 |
| InChI Key: | DBHTVYKJUZBVHY-UHFFFAOYSA-N |