2-ethyl-6-(2-methylpropyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
2-ethyl-6-(2-methylpropyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
2-ethyl-6-(2-methylpropyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C200-9629 |
| Compound Name: | 2-ethyl-6-(2-methylpropyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 410.46 |
| Molecular Formula: | C19 H21 F3 N4 O S |
| Smiles: | CCn1cc2c(C(N(CC(C)C)C(=N2)SCc2cccc(c2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1527 |
| logD: | 4.1527 |
| logSw: | -4.0763 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.182 |
| InChI Key: | HXTOCIXRVLHXLO-UHFFFAOYSA-N |