ethyl 4-{3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate
Chemical Structure Depiction of
ethyl 4-{3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate
ethyl 4-{3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate
Compound characteristics
| Compound ID: | F514-0479 |
| Compound Name: | ethyl 4-{3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate |
| Molecular Weight: | 445.5 |
| Molecular Formula: | C20 H23 N5 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CCn1c2ccc(cc2nn1)S(N(C)C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2839 |
| logD: | 2.2836 |
| logSw: | -3.0245 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.21 |
| InChI Key: | FOTQGFUCIIQIPO-UHFFFAOYSA-N |