(3,4-diethoxyphenyl){4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(3,4-diethoxyphenyl){4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
(3,4-diethoxyphenyl){4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | P803-1815 |
| Compound Name: | (3,4-diethoxyphenyl){4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 464.56 |
| Molecular Formula: | C26 H32 N4 O4 |
| Smiles: | CCOc1ccc(cc1OCC)C(N1CCCN(CC1)c1cc(c2ccc(cc2)OC)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6572 |
| logD: | 3.6572 |
| logSw: | -3.8079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.396 |
| InChI Key: | KHMGOULVEVWICS-UHFFFAOYSA-N |