1,3-dimethyl-7-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1,3-dimethyl-7-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1,3-dimethyl-7-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 6165-0287 |
| Compound Name: | 1,3-dimethyl-7-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 434.34 |
| Molecular Formula: | C18 H16 F6 N4 O2 |
| Smiles: | CN1C2=C(C(N(C)C1=O)=O)C(C(F)(F)F)(C(F)(F)F)N=C(CCc1ccccc1)N2 |
| Stereo: | ACHIRAL |
| logP: | 3.8697 |
| logD: | 3.8689 |
| logSw: | -4.0343 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.472 |
| InChI Key: | QQNRIMROBMVHMP-UHFFFAOYSA-N |