N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | C226-1929 |
Compound Name: | N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 419.29 |
Molecular Formula: | C18 H12 Cl2 N4 O2 S |
Smiles: | C(c1ccc(cc1[Cl])[Cl])n1cc(cn1)NC(c1cc(c2cccs2)on1)=O |
Stereo: | ACHIRAL |
logP: | 4.7596 |
logD: | 4.7593 |
logSw: | -4.9567 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.389 |
InChI Key: | WBERBCATLAGNRF-UHFFFAOYSA-N |