5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | E960-1027 |
| Compound Name: | 5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 448.59 |
| Molecular Formula: | C25 H28 N4 O2 S |
| Smiles: | CCn1c2C(N(Cc3ccc(cc3)OC)C(=Nc2c(C)n1)SCc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0657 |
| logD: | 5.0657 |
| logSw: | -4.6643 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.982 |
| InChI Key: | WFSCKHUXXBCLFV-UHFFFAOYSA-N |