N-[(2-chlorophenyl)methyl]-N~3~-[(2,6-dichlorophenyl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-N~3~-[(2,6-dichlorophenyl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
N-[(2-chlorophenyl)methyl]-N~3~-[(2,6-dichlorophenyl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | K783-2264 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-N~3~-[(2,6-dichlorophenyl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 525.88 |
| Molecular Formula: | C24 H23 Cl3 N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(N(CCC(NCc1ccccc1[Cl])=O)Cc1c(cccc1[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2722 |
| logD: | 6.2722 |
| logSw: | -6.0332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.792 |
| InChI Key: | MGZLGPAYPUQGAW-UHFFFAOYSA-N |