2-({1-ethyl-3-methyl-7-oxo-6-[(thiophen-2-yl)methyl]-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-({1-ethyl-3-methyl-7-oxo-6-[(thiophen-2-yl)methyl]-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide
2-({1-ethyl-3-methyl-7-oxo-6-[(thiophen-2-yl)methyl]-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide
Compound characteristics
Compound ID: | E960-1353 |
Compound Name: | 2-({1-ethyl-3-methyl-7-oxo-6-[(thiophen-2-yl)methyl]-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide |
Molecular Weight: | 405.54 |
Molecular Formula: | C18 H23 N5 O2 S2 |
Smiles: | CCn1c2C(N(Cc3cccs3)C(=Nc2c(C)n1)SCC(NC(C)C)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6697 |
logD: | 1.6697 |
logSw: | -2.4274 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.174 |
InChI Key: | HSZAOMMUTSVJKV-UHFFFAOYSA-N |