7-(2-fluorophenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-(2-fluorophenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-(2-fluorophenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8013-4615 |
| Compound Name: | 7-(2-fluorophenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 424.28 |
| Molecular Formula: | C16 H11 F7 N4 O2 |
| Smiles: | CN1C2=C(C(N(C)C1=O)=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccccc1F)N2 |
| Stereo: | ACHIRAL |
| logP: | 3.1223 |
| logD: | 2.3318 |
| logSw: | -3.6173 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.462 |
| InChI Key: | ZBNVUHPMTWHFGC-UHFFFAOYSA-N |