N~3~-(4-bromobenzene-1-sulfonyl)-N-butyl-beta-alaninamide
Chemical Structure Depiction of
N~3~-(4-bromobenzene-1-sulfonyl)-N-butyl-beta-alaninamide
N~3~-(4-bromobenzene-1-sulfonyl)-N-butyl-beta-alaninamide
Compound characteristics
| Compound ID: | K781-4173 |
| Compound Name: | N~3~-(4-bromobenzene-1-sulfonyl)-N-butyl-beta-alaninamide |
| Molecular Weight: | 363.27 |
| Molecular Formula: | C13 H19 Br N2 O3 S |
| Smiles: | CCCCNC(CCNS(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7068 |
| logD: | 2.7068 |
| logSw: | -3.152 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.423 |
| InChI Key: | CEUGZSLCKQSGNA-UHFFFAOYSA-N |