{4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone
Chemical Structure Depiction of
{4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone
{4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone
Compound characteristics
| Compound ID: | P803-1910 |
| Compound Name: | {4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone |
| Molecular Weight: | 427.51 |
| Molecular Formula: | C25 H25 N5 O2 |
| Smiles: | COc1ccc(cc1)c1cc([nH]n1)N1CCCN(CC1)C(c1ccc2c(cccn2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5962 |
| logD: | 3.5962 |
| logSw: | -3.4908 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.738 |
| InChI Key: | HTZJUYAOKMUUFL-UHFFFAOYSA-N |