N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G015-0361 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C23 H29 N5 O3 S |
| Smiles: | CCOc1ccc(CCNC(c2cccn2c2nnc(N3CCCC3)s2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.5694 |
| logD: | 3.5694 |
| logSw: | -3.7281 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.915 |
| InChI Key: | HJJLKOSPEVPSRI-UHFFFAOYSA-N |