4-[6-butyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[6-butyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide
4-[6-butyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V014-3172 |
| Compound Name: | 4-[6-butyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C24 H32 F N7 O |
| Salt: | not_available |
| Smiles: | CCCCc1nc(c2c(C)nn(c3ccc(cc3)F)c2n1)N1CCCN(CC1)C(NCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.34 |
| logD: | 3.7943 |
| logSw: | -4.4064 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.793 |
| InChI Key: | FUWFCNXBGYDQEV-UHFFFAOYSA-N |