6-[(4-chlorophenyl)methyl]-2-ethyl-5-{[(3-methylphenyl)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-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-[(4-chlorophenyl)methyl]-2-ethyl-5-{[(3-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0088 |
| Compound Name: | 6-[(4-chlorophenyl)methyl]-2-ethyl-5-{[(3-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 424.95 |
| Molecular Formula: | C22 H21 Cl N4 O S |
| Smiles: | CCn1cc2c(C(N(Cc3ccc(cc3)[Cl])C(=N2)SCc2cccc(C)c2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.998 |
| logD: | 4.998 |
| logSw: | -5.0125 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.91 |
| InChI Key: | YCMDXOXKHMWGHT-UHFFFAOYSA-N |