6-benzyl-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
6-benzyl-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-benzyl-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | E960-0387 |
| Compound Name: | 6-benzyl-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 390.51 |
| Molecular Formula: | C22 H22 N4 O S |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3cnn(C)c3C(N2Cc2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6585 |
| logD: | 4.6585 |
| logSw: | -4.3046 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.898 |
| InChI Key: | OWJJANSBQZPNMT-UHFFFAOYSA-N |