6-benzyl-1-(4-fluorophenyl)-3-methyl-4-{4-[(thiophen-2-yl)methyl]-1,4-diazepan-1-yl}-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-1-(4-fluorophenyl)-3-methyl-4-{4-[(thiophen-2-yl)methyl]-1,4-diazepan-1-yl}-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-1-(4-fluorophenyl)-3-methyl-4-{4-[(thiophen-2-yl)methyl]-1,4-diazepan-1-yl}-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V019-8748 |
| Compound Name: | 6-benzyl-1-(4-fluorophenyl)-3-methyl-4-{4-[(thiophen-2-yl)methyl]-1,4-diazepan-1-yl}-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 512.65 |
| Molecular Formula: | C29 H29 F N6 S |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(Cc3ccccc3)nc2n(c2ccc(cc2)F)n1)N1CCCN(CC1)Cc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 5.8153 |
| logD: | 5.6321 |
| logSw: | -5.8862 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.584 |
| InChI Key: | BEVQDDBYLZCEML-UHFFFAOYSA-N |