1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-3-yl)methyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-3-yl)methyl]-1H-pyrrole-2-carboxamide
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-3-yl)methyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | E002-2242 |
| Compound Name: | 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(pyridin-3-yl)methyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 382.49 |
| Molecular Formula: | C19 H22 N6 O S |
| Smiles: | C1CCCN(CC1)c1nnc(n2cccc2C(NCc2cccnc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.199 |
| logD: | 3.1989 |
| logSw: | -3.0992 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.136 |
| InChI Key: | KHSVFWQXEIITLZ-UHFFFAOYSA-N |