N~4~-[(2S)-3-methyl-1-oxo-1-{[2-(4-sulfamoylphenyl)ethyl]amino}butan-2-yl]-N~3~-[2-(4-sulfamoylphenyl)ethyl]pyridine-3,4-dicarboxamide
Chemical Structure Depiction of
N~4~-[(2S)-3-methyl-1-oxo-1-{[2-(4-sulfamoylphenyl)ethyl]amino}butan-2-yl]-N~3~-[2-(4-sulfamoylphenyl)ethyl]pyridine-3,4-dicarboxamide
N~4~-[(2S)-3-methyl-1-oxo-1-{[2-(4-sulfamoylphenyl)ethyl]amino}butan-2-yl]-N~3~-[2-(4-sulfamoylphenyl)ethyl]pyridine-3,4-dicarboxamide
Compound characteristics
| Compound ID: | Y041-5031 |
| Compound Name: | N~4~-[(2S)-3-methyl-1-oxo-1-{[2-(4-sulfamoylphenyl)ethyl]amino}butan-2-yl]-N~3~-[2-(4-sulfamoylphenyl)ethyl]pyridine-3,4-dicarboxamide |
| Molecular Weight: | 630.74 |
| Molecular Formula: | C28 H34 N6 O7 S2 |
| Smiles: | CC(C)[C@@H](C(NCCc1ccc(cc1)S(N)(=O)=O)=O)NC(c1ccncc1C(NCCc1ccc(cc1)S(N)(=O)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.2686 |
| logD: | -0.2693 |
| logSw: | -1.8812 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 7 |
| Polar surface area: | 183.509 |
| InChI Key: | OPBOABJTEIQGAU-VWLOTQADSA-N |