3-methyl-2-nitro-N-{4-[(2-phenylethyl)sulfamoyl]phenyl}benzamide
Chemical Structure Depiction of
3-methyl-2-nitro-N-{4-[(2-phenylethyl)sulfamoyl]phenyl}benzamide
3-methyl-2-nitro-N-{4-[(2-phenylethyl)sulfamoyl]phenyl}benzamide
Compound characteristics
Compound ID: | Y032-3276 |
Compound Name: | 3-methyl-2-nitro-N-{4-[(2-phenylethyl)sulfamoyl]phenyl}benzamide |
Molecular Weight: | 439.49 |
Molecular Formula: | C22 H21 N3 O5 S |
Smiles: | Cc1cccc(C(Nc2ccc(cc2)S(NCCc2ccccc2)(=O)=O)=O)c1[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.2269 |
logD: | 2.5978 |
logSw: | -4.5243 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 97.709 |
InChI Key: | DKTSHXWMLNLXKL-UHFFFAOYSA-N |