{4-[6-benzyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-1-yl)methanone
Chemical Structure Depiction of
{4-[6-benzyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-1-yl)methanone
{4-[6-benzyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-1-yl)methanone
Compound characteristics
| Compound ID: | V019-7107 |
| Compound Name: | {4-[6-benzyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(naphthalen-1-yl)methanone |
| Molecular Weight: | 570.67 |
| Molecular Formula: | C35 H31 F N6 O |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(Cc3ccccc3)nc2n(c2ccc(cc2)F)n1)N1CCCN(CC1)C(c1cccc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5488 |
| logD: | 6.447 |
| logSw: | -6.895 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.21 |
| InChI Key: | HJUPYSNARHBAHS-UHFFFAOYSA-N |