1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxamide
1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxamide
Compound characteristics
Compound ID: | G015-0636 |
Compound Name: | 1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxamide |
Molecular Weight: | 450.48 |
Molecular Formula: | C20 H21 F3 N6 O S |
Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2C(Nc2cccc(c2)C(F)(F)F)=O)s1 |
Stereo: | ACHIRAL |
logP: | 4.3934 |
logD: | 3.5363 |
logSw: | -4.1831 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.501 |
InChI Key: | ADHCOGZHOFFPSZ-UHFFFAOYSA-N |