methyl 3-{[4-(acetylsulfamoyl)phenyl]carbamoyl}-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-{[4-(acetylsulfamoyl)phenyl]carbamoyl}-5-nitrobenzoate
methyl 3-{[4-(acetylsulfamoyl)phenyl]carbamoyl}-5-nitrobenzoate
Compound characteristics
| Compound ID: | 3136-2470 |
| Compound Name: | methyl 3-{[4-(acetylsulfamoyl)phenyl]carbamoyl}-5-nitrobenzoate |
| Molecular Weight: | 421.38 |
| Molecular Formula: | C17 H15 N3 O8 S |
| Smiles: | CC(NS(c1ccc(cc1)NC(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.411 |
| logD: | -0.8676 |
| logSw: | -2.4582 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.884 |
| InChI Key: | LMDXGVJHNXPGSJ-UHFFFAOYSA-N |