6-[(4-chlorophenyl)methyl]-2-ethyl-5-{[(3-fluorophenyl)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-fluorophenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-[(4-chlorophenyl)methyl]-2-ethyl-5-{[(3-fluorophenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0094 |
| Compound Name: | 6-[(4-chlorophenyl)methyl]-2-ethyl-5-{[(3-fluorophenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 428.91 |
| Molecular Formula: | C21 H18 Cl F N4 O S |
| Smiles: | CCn1cc2c(C(N(Cc3ccc(cc3)[Cl])C(=N2)SCc2cccc(c2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4736 |
| logD: | 4.4736 |
| logSw: | -4.593 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.91 |
| InChI Key: | FWEKVLBWDYYJEG-UHFFFAOYSA-N |