ethyl 4-{3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate
Chemical Structure Depiction of
ethyl 4-{3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate
ethyl 4-{3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate
Compound characteristics
| Compound ID: | F514-0618 |
| Compound Name: | ethyl 4-{3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]propanamido}benzoate |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C22 H27 N5 O5 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCC(Nc1ccc(cc1)C(=O)OCC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8704 |
| logD: | 2.8701 |
| logSw: | -3.581 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.642 |
| InChI Key: | FGFSQXMFYOBLIR-UHFFFAOYSA-N |