6-[(4-chlorophenyl)methyl]-2-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[(4-chlorophenyl)methyl]-2-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-[(4-chlorophenyl)methyl]-2-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0089 |
| Compound Name: | 6-[(4-chlorophenyl)methyl]-2-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 478.92 |
| Molecular Formula: | C22 H18 Cl F3 N4 O S |
| Smiles: | CCn1cc2c(C(N(Cc3ccc(cc3)[Cl])C(=N2)SCc2cccc(c2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.1082 |
| logD: | 5.1082 |
| logSw: | -5.5268 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.91 |
| InChI Key: | LEIQTWIIFZEKMO-UHFFFAOYSA-N |