N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(3-methylphenyl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(3-methylphenyl)-beta-alaninamide
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(3-methylphenyl)-beta-alaninamide
Compound characteristics
| Compound ID: | E199-0171 |
| Compound Name: | N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(3-methylphenyl)-beta-alaninamide |
| Molecular Weight: | 413.29 |
| Molecular Formula: | C15 H17 Br N4 O3 S |
| Smiles: | Cc1cccc(c1)NC(CCNS(c1cc(cnc1N)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1346 |
| logD: | 2.134 |
| logSw: | -2.8794 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.822 |
| InChI Key: | HTANPPQILXYYLL-UHFFFAOYSA-N |