N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide
N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | K906-3654 |
| Compound Name: | N~3~-(2-amino-5-bromopyridine-3-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide |
| Molecular Weight: | 403.25 |
| Molecular Formula: | C13 H15 Br N4 O4 S |
| Smiles: | C(CNS(c1cc(cnc1N)[Br])(=O)=O)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2256 |
| logD: | 1.2251 |
| logSw: | -2.357 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 103.893 |
| InChI Key: | CBHMDYGCKNKLDG-UHFFFAOYSA-N |