N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[2-(azepan-1-yl)ethyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[2-(azepan-1-yl)ethyl]-beta-alaninamide
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[2-(azepan-1-yl)ethyl]-beta-alaninamide
Compound characteristics
| Compound ID: | E199-0179 |
| Compound Name: | N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[2-(azepan-1-yl)ethyl]-beta-alaninamide |
| Molecular Weight: | 448.38 |
| Molecular Formula: | C16 H26 Br N5 O3 S |
| Smiles: | C1CCCN(CC1)CCNC(CCNS(c1cc(cnc1N)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9913 |
| logD: | -0.7075 |
| logSw: | -2.2273 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 100.299 |
| InChI Key: | BVVGFTOVFWZCDV-UHFFFAOYSA-N |