2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C700-0220 |
| Compound Name: | 2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
| Molecular Weight: | 550.65 |
| Molecular Formula: | C24 H30 N4 O7 S2 |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)N(CC(NCCc1ccc(cc1)S(N)(=O)=O)=O)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7618 |
| logD: | 0.761 |
| logSw: | -2.5196 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 130.695 |
| InChI Key: | CAKAOXHJXNNXSR-UHFFFAOYSA-N |