4-[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide
4-[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V026-1658 |
| Compound Name: | 4-[3,6-dimethyl-1-(2-methylphenyl)-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)c1c2c(C)nn(c3ccccc3C)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9022 |
| logD: | 3.2897 |
| logSw: | -4.0703 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.33 |
| InChI Key: | PPZQZTDGHIICCH-UHFFFAOYSA-N |