6-benzyl-2-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
6-benzyl-2-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-benzyl-2-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0522F |
| Compound Name: | 6-benzyl-2-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 430.45 |
| Molecular Formula: | C21 H17 F3 N4 O S |
| Smiles: | Cn1cc2c(C(N(Cc3ccccc3)C(=N2)SCc2cccc(c2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1062 |
| logD: | 4.1062 |
| logSw: | -4.163 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.217 |
| InChI Key: | VRLXRBCDVIRNRT-UHFFFAOYSA-N |