2-ethyl-6-[(4-methoxyphenyl)methyl]-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
2-ethyl-6-[(4-methoxyphenyl)methyl]-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
2-ethyl-6-[(4-methoxyphenyl)methyl]-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0135 |
| Compound Name: | 2-ethyl-6-[(4-methoxyphenyl)methyl]-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 474.5 |
| Molecular Formula: | C23 H21 F3 N4 O2 S |
| Smiles: | CCn1cc2c(C(N(Cc3ccc(cc3)OC)C(=N2)SCc2cccc(c2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4958 |
| logD: | 4.4958 |
| logSw: | -4.3113 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.454 |
| InChI Key: | JUEFHQOZXPGFGN-UHFFFAOYSA-N |