N-{1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}thiophene-2-carboxamide
N-{1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}thiophene-2-carboxamide
Compound characteristics
Compound ID: | P014-1315 |
Compound Name: | N-{1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}thiophene-2-carboxamide |
Molecular Weight: | 414.91 |
Molecular Formula: | C20 H19 Cl N4 O2 S |
Smiles: | C1CN(CCC1NC(c1cccs1)=O)C(c1cc(c2cccc(c2)[Cl])n[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 3.7859 |
logD: | 3.7854 |
logSw: | -4.3391 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.341 |
InChI Key: | PWTVRKYJXGGZLX-UHFFFAOYSA-N |