2,6-dimethyl-N-[(3-methylphenyl)methyl]-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
2,6-dimethyl-N-[(3-methylphenyl)methyl]-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonamide
2,6-dimethyl-N-[(3-methylphenyl)methyl]-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | D445-0316 |
Compound Name: | 2,6-dimethyl-N-[(3-methylphenyl)methyl]-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonamide |
Molecular Weight: | 422.52 |
Molecular Formula: | C19 H22 N2 O5 S2 |
Smiles: | Cc1cccc(CNS(c2c(C)cc(cc2C)N2C(CCS2(=O)=O)=O)(=O)=O)c1 |
Stereo: | ACHIRAL |
logP: | 2.7445 |
logD: | 2.743 |
logSw: | -3.0835 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.414 |
InChI Key: | IKQAOAYCDCXLAB-UHFFFAOYSA-N |