7-ethyl-1-[(furan-2-yl)methyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-ethyl-1-[(furan-2-yl)methyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-ethyl-1-[(furan-2-yl)methyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8013-2051 |
| Compound Name: | 7-ethyl-1-[(furan-2-yl)methyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 410.27 |
| Molecular Formula: | C15 H12 F6 N4 O3 |
| Smiles: | CCC1NC2=C(C(NC(N2Cc2ccco2)=O)=O)C(C(F)(F)F)(C(F)(F)F)N=1 |
| Stereo: | ACHIRAL |
| logP: | 2.8332 |
| logD: | 2.8331 |
| logSw: | -3.1877 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.369 |
| InChI Key: | NJBRSZMOFRYILY-UHFFFAOYSA-N |