N~3~-(4-methoxybenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(4-methoxybenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninamide
N~3~-(4-methoxybenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | K784-9254 |
| Compound Name: | N~3~-(4-methoxybenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninamide |
| Molecular Weight: | 354.44 |
| Molecular Formula: | C15 H18 N2 O4 S2 |
| Smiles: | COc1ccc(cc1)S(NCCC(NCc1cccs1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1766 |
| logD: | 2.1766 |
| logSw: | -2.7178 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.872 |
| InChI Key: | DRBJGRKYXYTYSF-UHFFFAOYSA-N |