cyclopropyl{4-[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
cyclopropyl{4-[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
cyclopropyl{4-[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V025-0659 |
| Compound Name: | cyclopropyl{4-[6-ethyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C24 H30 N6 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccc(C)cc3)c2n1)N1CCCN(CC1)C(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2006 |
| logD: | 3.8252 |
| logSw: | -4.3088 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.276 |
| InChI Key: | YHWBKETZKDWYON-UHFFFAOYSA-N |