N-(3,4-dimethoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
N-(3,4-dimethoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G015-0850 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 456.57 |
| Molecular Formula: | C22 H28 N6 O3 S |
| Smiles: | CCCN1CCN(CC1)c1nnc(n2cccc2C(Nc2ccc(c(c2)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3525 |
| logD: | 2.4793 |
| logSw: | -3.5821 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.016 |
| InChI Key: | CRUXWWAJXIWVAH-UHFFFAOYSA-N |