N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methylbenzene-1-sulfonamide
N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methylbenzene-1-sulfonamide
Compound characteristics
Compound ID: | D344-2836 |
Compound Name: | N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methylbenzene-1-sulfonamide |
Molecular Weight: | 412.89 |
Molecular Formula: | C21 H17 Cl N2 O3 S |
Smiles: | Cc1ccc(cc1)S(Nc1cccc(c1C)c1nc2cc(ccc2o1)[Cl])(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.6037 |
logD: | 5.5973 |
logSw: | -6.002 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57 |
InChI Key: | CSJDJRLEMGKWQK-UHFFFAOYSA-N |