N-{1-[2-(azepan-1-yl)-2-oxoethyl]-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{1-[2-(azepan-1-yl)-2-oxoethyl]-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}-4-methylbenzene-1-sulfonamide
N-{1-[2-(azepan-1-yl)-2-oxoethyl]-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | P122-0787 |
| Compound Name: | N-{1-[2-(azepan-1-yl)-2-oxoethyl]-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Smiles: | CC1=CC=C(C(N1CC(N1CCCCCC1)=O)=O)NS(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.605 |
| logD: | -1.2948 |
| logSw: | -3.1586 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.763 |
| InChI Key: | NWRDVEOPBYGQDF-UHFFFAOYSA-N |