N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(4-methoxyphenyl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(4-methoxyphenyl)methyl]-beta-alaninamide
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(4-methoxyphenyl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | E199-0059 |
| Compound Name: | N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(4-methoxyphenyl)methyl]-beta-alaninamide |
| Molecular Weight: | 443.32 |
| Molecular Formula: | C16 H19 Br N4 O4 S |
| Smiles: | COc1ccc(CNC(CCNS(c2cc(cnc2N)[Br])(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.4573 |
| logD: | 1.4568 |
| logSw: | -2.5306 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 103.688 |
| InChI Key: | RFGLUFXPQLAMTD-UHFFFAOYSA-N |