N-[3-(azepan-1-yl)propyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide
N-[3-(azepan-1-yl)propyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C361-2552 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 465.64 |
| Molecular Formula: | C21 H31 N5 O3 S2 |
| Smiles: | C1CCCN(CC1)CCCNC(C1CCN(CC1)S(c1cccc2c1nsn2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3929 |
| logD: | -0.2357 |
| logSw: | -2.6673 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.47 |
| InChI Key: | OSZKSJJQNZKLMN-UHFFFAOYSA-N |