{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methylphenyl)methanone
Chemical Structure Depiction of
{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methylphenyl)methanone
{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methylphenyl)methanone
Compound characteristics
| Compound ID: | V024-7705 |
| Compound Name: | {4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methylphenyl)methanone |
| Molecular Weight: | 496.61 |
| Molecular Formula: | C29 H32 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N1CCCN(CC1)c1c2c(C)nn(c3ccc(cc3)OC)c2nc(C2CC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0962 |
| logD: | 3.4592 |
| logSw: | -5.0753 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.558 |
| InChI Key: | NYAVZQBBJWFJAQ-UHFFFAOYSA-N |