N-[2-(azepane-1-carbonyl)-1-benzofuran-3-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepane-1-carbonyl)-1-benzofuran-3-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide
N-[2-(azepane-1-carbonyl)-1-benzofuran-3-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E002-2741 |
| Compound Name: | N-[2-(azepane-1-carbonyl)-1-benzofuran-3-yl]-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 523.65 |
| Molecular Formula: | C28 H33 N3 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(Nc1c2ccccc2oc1C(N1CCCCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4654 |
| logD: | 4.3761 |
| logSw: | -4.1027 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.15 |
| InChI Key: | PKWSUNQUJOVBEW-UHFFFAOYSA-N |