N-[(2-chlorophenyl)methyl]-2-{[2-ethyl-7-oxo-6-(2-phenylethyl)-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-{[2-ethyl-7-oxo-6-(2-phenylethyl)-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide
N-[(2-chlorophenyl)methyl]-2-{[2-ethyl-7-oxo-6-(2-phenylethyl)-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G020-0147 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{[2-ethyl-7-oxo-6-(2-phenylethyl)-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 482 |
| Molecular Formula: | C24 H24 Cl N5 O2 S |
| Smiles: | CCn1cc2c(C(N(CCc3ccccc3)C(=N2)SCC(NCc2ccccc2[Cl])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.717 |
| logD: | 3.717 |
| logSw: | -3.8793 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.36 |
| InChI Key: | ALEGOEMTNNIVAX-UHFFFAOYSA-N |