N-(3-methoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
N-(3-methoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Compound characteristics
Compound ID: | G015-0852 |
Compound Name: | N-(3-methoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide |
Molecular Weight: | 426.54 |
Molecular Formula: | C21 H26 N6 O2 S |
Smiles: | CCCN1CCN(CC1)c1nnc(n2cccc2C(Nc2cccc(c2)OC)=O)s1 |
Stereo: | ACHIRAL |
logP: | 3.8841 |
logD: | 3.0109 |
logSw: | -3.9463 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.299 |
InChI Key: | JKHHYUSMBNBFHW-UHFFFAOYSA-N |