{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-2-yl)methanone
Chemical Structure Depiction of
{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-2-yl)methanone
{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-2-yl)methanone
Compound characteristics
| Compound ID: | V015-2805 |
| Compound Name: | {4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-2-yl)methanone |
| Molecular Weight: | 504.64 |
| Molecular Formula: | C31 H32 N6 O |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1ccc2ccccc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4798 |
| logD: | 6.3962 |
| logSw: | -6.6223 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.128 |
| InChI Key: | XPVFJWLAVAXWFI-UHFFFAOYSA-N |