(3-fluorophenyl){4-[6-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(3-fluorophenyl){4-[6-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
(3-fluorophenyl){4-[6-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V024-9282 |
| Compound Name: | (3-fluorophenyl){4-[6-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C25 H25 F N6 O |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)c(nc(C)n2)N1CCCN(CC1)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4877 |
| logD: | 4.4462 |
| logSw: | -4.284 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.022 |
| InChI Key: | JHRVUWZPPZOXSH-UHFFFAOYSA-N |