N-[2-(azepan-1-yl)ethyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C361-2554 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C20 H29 N5 O3 S2 |
| Smiles: | C1CCCN(CC1)CCNC(C1CCN(CC1)S(c1cccc2c1nsn2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2697 |
| logD: | 0.487 |
| logSw: | -2.6266 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.47 |
| InChI Key: | LEUJVTBLCURUMG-UHFFFAOYSA-N |