ethyl 4-oxo-2,2-bis(trifluoromethyl)-1,4-dihydroquinazoline-3(2H)-carboxylate
Chemical Structure Depiction of
ethyl 4-oxo-2,2-bis(trifluoromethyl)-1,4-dihydroquinazoline-3(2H)-carboxylate
ethyl 4-oxo-2,2-bis(trifluoromethyl)-1,4-dihydroquinazoline-3(2H)-carboxylate
Compound characteristics
| Compound ID: | 5256-0805 |
| Compound Name: | ethyl 4-oxo-2,2-bis(trifluoromethyl)-1,4-dihydroquinazoline-3(2H)-carboxylate |
| Molecular Weight: | 356.22 |
| Molecular Formula: | C13 H10 F6 N2 O3 |
| Smiles: | CCOC(N1C(c2ccccc2NC1(C(F)(F)F)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3588 |
| logD: | 1.3241 |
| logSw: | -3.725 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.057 |
| InChI Key: | GIILDSMAVKBKOU-UHFFFAOYSA-N |