7-methyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-methyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-methyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8013-1454 |
| Compound Name: | 7-methyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 473.38 |
| Molecular Formula: | C20 H17 F6 N5 O2 |
| Smiles: | CC1NC2=C(C(NC(N2CCc2c3ccccc3[nH]c2C)=O)=O)C(C(F)(F)F)(C(F)(F)F)N=1 |
| Stereo: | ACHIRAL |
| logP: | 3.6535 |
| logD: | 3.6534 |
| logSw: | -4.2205 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.187 |
| InChI Key: | CVEJYJOVFFGZAQ-UHFFFAOYSA-N |