7-benzyl-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-benzyl-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-benzyl-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 6165-0040 |
| Compound Name: | 7-benzyl-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 496.41 |
| Molecular Formula: | C23 H18 F6 N4 O2 |
| Smiles: | C(CN1C2=C(C(NC1=O)=O)C(C(F)(F)F)(C(F)(F)F)N=C(Cc1ccccc1)N2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8251 |
| logD: | 4.8244 |
| logSw: | -4.7913 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.327 |
| InChI Key: | MMMYCHBETMGDHW-UHFFFAOYSA-N |