1-ethyl-6-[(4-fluorophenyl)methyl]-3-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
1-ethyl-6-[(4-fluorophenyl)methyl]-3-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
1-ethyl-6-[(4-fluorophenyl)methyl]-3-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | E960-1200 |
| Compound Name: | 1-ethyl-6-[(4-fluorophenyl)methyl]-3-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 476.49 |
| Molecular Formula: | C23 H20 F4 N4 O S |
| Smiles: | CCn1c2C(N(Cc3ccc(cc3)F)C(=Nc2c(C)n1)SCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6416 |
| logD: | 4.6416 |
| logSw: | -4.5067 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.438 |
| InChI Key: | DUWIXYYGYOLCMM-UHFFFAOYSA-N |