2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K788-9780 |
| Compound Name: | 2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 583.73 |
| Molecular Formula: | C32 H29 N3 O4 S2 |
| Smiles: | Cc1cccc(CN2C(/C(=C/c3ccccc3)Sc3ccc(cc23)C(NCCc2ccc(cc2)S(N)(=O)=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1843 |
| logD: | 5.1836 |
| logSw: | -4.9725 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.927 |
| InChI Key: | KMMJZJPGICBDBO-UHFFFAOYSA-N |