4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide
4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V026-2076 |
| Compound Name: | 4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C23 H31 N7 O |
| Salt: | not_available |
| Smiles: | CCCNC(N1CCCN(CC1)c1c2cnn(c3ccc(C)cc3C)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8222 |
| logD: | 4.7131 |
| logSw: | -4.484 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.977 |
| InChI Key: | JBDYWHWLSVJKDO-UHFFFAOYSA-N |