(3,5-dimethoxyphenyl){4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(3,5-dimethoxyphenyl){4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
(3,5-dimethoxyphenyl){4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | P803-1331 |
| Compound Name: | (3,5-dimethoxyphenyl){4-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C23 H25 F N4 O3 |
| Smiles: | COc1cc(cc(c1)OC)C(N1CCCN(CC1)c1cc(c2ccc(cc2)F)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8722 |
| logD: | 3.8722 |
| logSw: | -3.9707 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.519 |
| InChI Key: | FVTOEOCYRNFGJS-UHFFFAOYSA-N |