{4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone
{4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Compound characteristics
Compound ID: | P803-1832 |
Compound Name: | {4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone |
Molecular Weight: | 376.46 |
Molecular Formula: | C22 H24 N4 O2 |
Smiles: | COc1ccc(cc1)c1cc([nH]n1)N1CCCN(CC1)C(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.5208 |
logD: | 3.5208 |
logSw: | -3.7543 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.975 |
InChI Key: | PBRXFZIIPLFODF-UHFFFAOYSA-N |