N-[(4-chlorophenyl)methyl]-2-{[6-(cyclopropylmethyl)-2-methyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{[6-(cyclopropylmethyl)-2-methyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide
N-[(4-chlorophenyl)methyl]-2-{[6-(cyclopropylmethyl)-2-methyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G020-0441 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-{[6-(cyclopropylmethyl)-2-methyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 417.92 |
| Molecular Formula: | C19 H20 Cl N5 O2 S |
| Smiles: | Cn1cc2c(C(N(CC3CC3)C(=N2)SCC(NCc2ccc(cc2)[Cl])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.2765 |
| logD: | 2.2765 |
| logSw: | -3.2687 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.212 |
| InChI Key: | JOODVWUAUZKGGY-UHFFFAOYSA-N |