1-(4-methoxyphenyl)-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-(4-methoxyphenyl)-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1-(4-methoxyphenyl)-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 6259-6979 |
| Compound Name: | 1-(4-methoxyphenyl)-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 485.34 |
| Molecular Formula: | C20 H13 F6 N5 O3 |
| Smiles: | COc1ccc(cc1)N1C2=C(C(NC1=O)=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1cccnc1)N2 |
| Stereo: | ACHIRAL |
| logP: | 2.666 |
| logD: | 2.4781 |
| logSw: | -2.9066 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.789 |
| InChI Key: | IXQRKQWICHGALL-UHFFFAOYSA-N |