cyclobutyl{4-[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
cyclobutyl{4-[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
cyclobutyl{4-[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V025-0735 |
| Compound Name: | cyclobutyl{4-[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 448.57 |
| Molecular Formula: | C25 H32 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)n1)c(nc(COC)n2)N1CCCN(CC1)C(C1CCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3038 |
| logD: | 3.0644 |
| logSw: | -3.4863 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 63.7 |
| InChI Key: | XTEOYSQAJIMENX-UHFFFAOYSA-N |