3-[(4-methoxyphenyl)methyl]-1-{[3-(trifluoromethyl)phenyl]methyl}pteridine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-1-{[3-(trifluoromethyl)phenyl]methyl}pteridine-2,4(1H,3H)-dione
3-[(4-methoxyphenyl)methyl]-1-{[3-(trifluoromethyl)phenyl]methyl}pteridine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F462-1013 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-1-{[3-(trifluoromethyl)phenyl]methyl}pteridine-2,4(1H,3H)-dione |
| Molecular Weight: | 442.4 |
| Molecular Formula: | C22 H17 F3 N4 O3 |
| Smiles: | COc1ccc(CN2C(c3c(nccn3)N(Cc3cccc(c3)C(F)(F)F)C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0675 |
| logD: | 4.0675 |
| logSw: | -4.3355 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.05 |
| InChI Key: | ITZKBNPPSOBLBE-UHFFFAOYSA-N |