{4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone
Chemical Structure Depiction of
{4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone
{4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | V025-2054 |
| Compound Name: | {4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C27 H30 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(C)c1)n1c2c(cn1)c(nc(C)n2)N1CCCN(CC1)C(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.108 |
| logD: | 4.9988 |
| logSw: | -4.9514 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.265 |
| InChI Key: | ZDHPLCMTPSJLTG-UHFFFAOYSA-N |