7-(furan-2-yl)-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-(furan-2-yl)-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-(furan-2-yl)-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 7591-0304 |
| Compound Name: | 7-(furan-2-yl)-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 472.34 |
| Molecular Formula: | C20 H14 F6 N4 O3 |
| Smiles: | C(CN1C2=C(C(NC1=O)=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccco1)N2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7511 |
| logD: | 3.6843 |
| logSw: | -4.0872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.896 |
| InChI Key: | IRFJLFXPRICEGZ-UHFFFAOYSA-N |