methyl 2-({4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}sulfamoyl)benzoate
Chemical Structure Depiction of
methyl 2-({4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}sulfamoyl)benzoate
methyl 2-({4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}sulfamoyl)benzoate
Compound characteristics
| Compound ID: | M346-0291 |
| Compound Name: | methyl 2-({4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}sulfamoyl)benzoate |
| Molecular Weight: | 372.4 |
| Molecular Formula: | C17 H16 N4 O4 S |
| Smiles: | COC(c1ccccc1S(Nc1ccc(Cn2cncn2)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4957 |
| logD: | 1.4804 |
| logSw: | -2.3534 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.039 |
| InChI Key: | ATEGAQLKCGQFIP-UHFFFAOYSA-N |