N-(1-butyl-5-methyl-1H-pyrazol-3-yl)-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide
Chemical Structure Depiction of
N-(1-butyl-5-methyl-1H-pyrazol-3-yl)-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide
N-(1-butyl-5-methyl-1H-pyrazol-3-yl)-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide
Compound characteristics
| Compound ID: | Y501-3181 |
| Compound Name: | N-(1-butyl-5-methyl-1H-pyrazol-3-yl)-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide |
| Molecular Weight: | 343.39 |
| Molecular Formula: | C16 H21 N7 O2 |
| Smiles: | CCCCn1c(C)cc(NC(CN2C=Nc3c(cnn3C)C2=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7939 |
| logD: | 0.7688 |
| logSw: | -2.0073 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.606 |
| InChI Key: | CXXMQRLDYAXERX-UHFFFAOYSA-N |