3-chloro-2-methyl-N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-2-methyl-N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
3-chloro-2-methyl-N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | G718-1374 |
Compound Name: | 3-chloro-2-methyl-N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide |
Molecular Weight: | 404.92 |
Molecular Formula: | C19 H21 Cl N4 O2 S |
Smiles: | Cc1cccc(Cc2nc(CCNS(c3cccc(c3C)[Cl])(=O)=O)n[nH]2)c1 |
Stereo: | ACHIRAL |
logP: | 4.6593 |
logD: | 4.657 |
logSw: | -4.7445 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.604 |
InChI Key: | LCTHREOQTPXFLT-UHFFFAOYSA-N |