2-(2H-benzotriazol-2-yl)-4-methylphenyl 4-[(methoxycarbonyl)amino]benzene-1-sulfonate
Chemical Structure Depiction of
2-(2H-benzotriazol-2-yl)-4-methylphenyl 4-[(methoxycarbonyl)amino]benzene-1-sulfonate
2-(2H-benzotriazol-2-yl)-4-methylphenyl 4-[(methoxycarbonyl)amino]benzene-1-sulfonate
Compound characteristics
| Compound ID: | 8006-3204 |
| Compound Name: | 2-(2H-benzotriazol-2-yl)-4-methylphenyl 4-[(methoxycarbonyl)amino]benzene-1-sulfonate |
| Molecular Weight: | 438.46 |
| Molecular Formula: | C21 H18 N4 O5 S |
| Smiles: | Cc1ccc(c(c1)n1nc2ccccc2n1)OS(c1ccc(cc1)NC(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3915 |
| logD: | 4.3877 |
| logSw: | -4.386 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.684 |
| InChI Key: | IIRJHLPJPLJDDW-UHFFFAOYSA-N |