N-benzyl-N-methyl-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-benzyl-N-methyl-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
N-benzyl-N-methyl-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | Y032-4342 |
| Compound Name: | N-benzyl-N-methyl-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 346.45 |
| Molecular Formula: | C18 H22 N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(NCCC(N(C)Cc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1737 |
| logD: | 3.1736 |
| logSw: | -3.486 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.733 |
| InChI Key: | CNFZOQMIBZJSMA-UHFFFAOYSA-N |