1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(piperidin-1-yl)propyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(piperidin-1-yl)propyl]-1H-pyrrole-2-carboxamide
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(piperidin-1-yl)propyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | E002-2275 |
| Compound Name: | 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(piperidin-1-yl)propyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 416.59 |
| Molecular Formula: | C21 H32 N6 O S |
| Smiles: | C1CCCN(CC1)c1nnc(n2cccc2C(NCCCN2CCCCC2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7292 |
| logD: | 1.133 |
| logSw: | -3.8535 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.442 |
| InChI Key: | UNKCDBSBJPICND-UHFFFAOYSA-N |