1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrrole-2-carboxamide
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | E002-2282 |
| Compound Name: | 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 391.53 |
| Molecular Formula: | C19 H29 N5 O2 S |
| Smiles: | CC(C)OCCCNC(c1cccn1c1nnc(N2CCCCCC2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5931 |
| logD: | 3.5931 |
| logSw: | -3.6162 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.932 |
| InChI Key: | RTQQXDULBAWILY-UHFFFAOYSA-N |