[3-(dimethylamino)phenyl]{4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
[3-(dimethylamino)phenyl]{4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
[3-(dimethylamino)phenyl]{4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | P803-1339 |
| Compound Name: | [3-(dimethylamino)phenyl]{4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C23 H26 F N5 O |
| Smiles: | CN(C)c1cccc(c1)C(N1CCCN(CC1)c1cc(c2ccc(cc2)F)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.906 |
| logD: | 3.906 |
| logSw: | -3.9448 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.236 |
| InChI Key: | FXNLFIZXBNAEHX-UHFFFAOYSA-N |