1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-2-yl)methyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-2-yl)methyl]-1H-pyrrole-2-carboxamide
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-2-yl)methyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | E002-2132 |
| Compound Name: | 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-2-yl)methyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 382.49 |
| Molecular Formula: | C19 H22 N6 O S |
| Smiles: | C1CCCN(CC1)c1nnc(n2cccc2C(NCc2ccccn2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.5169 |
| logD: | 3.5168 |
| logSw: | -3.6201 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.161 |
| InChI Key: | YIVQUDZKRWJEOI-UHFFFAOYSA-N |