N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(4-methylpyridin-2-yl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(4-methylpyridin-2-yl)-beta-alaninamide
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(4-methylpyridin-2-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | E199-0085 |
| Compound Name: | N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-(4-methylpyridin-2-yl)-beta-alaninamide |
| Molecular Weight: | 414.28 |
| Molecular Formula: | C14 H16 Br N5 O3 S |
| Smiles: | Cc1ccnc(c1)NC(CCNS(c1cc(cnc1N)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3013 |
| logD: | 1.3003 |
| logSw: | -2.3651 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 104.437 |
| InChI Key: | LOJYKTVQRCYARR-UHFFFAOYSA-N |