(4-chlorophenyl){4-[6-cyclopropyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(4-chlorophenyl){4-[6-cyclopropyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
(4-chlorophenyl){4-[6-cyclopropyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V024-9319 |
| Compound Name: | (4-chlorophenyl){4-[6-cyclopropyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 487 |
| Molecular Formula: | C27 H27 Cl N6 O |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)c(nc(C1CC1)n2)N1CCCN(CC1)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9133 |
| logD: | 5.2226 |
| logSw: | -6.2029 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.661 |
| InChI Key: | NYJMKMNHRQVRTD-UHFFFAOYSA-N |