{4-[6-(methoxymethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[6-(methoxymethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone
{4-[6-(methoxymethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | V020-5838 |
| Compound Name: | {4-[6-(methoxymethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone |
| Molecular Weight: | 456.55 |
| Molecular Formula: | C26 H28 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(COC)nc2n(c2ccccc2)n1)N1CCCN(CC1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3386 |
| logD: | 3.0992 |
| logSw: | -3.6898 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 63.177 |
| InChI Key: | WXMPJLAHPOBMSY-UHFFFAOYSA-N |