N-[3-(azepan-1-yl)propyl]-1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-[3-(azepan-1-yl)propyl]-1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E017-0216 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 434.6 |
| Molecular Formula: | C21 H34 N6 O2 S |
| Smiles: | C1CCCN(CC1)CCCNC(C1CCN(CC1)c1nnc(N2CCCC2=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0693 |
| logD: | -0.5593 |
| logSw: | -2.3952 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.21 |
| InChI Key: | ZKQLRUGOEBACPO-UHFFFAOYSA-N |