N-{4-[({1-[(4-methylphenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene}methyl)amino]phenyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{4-[({1-[(4-methylphenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene}methyl)amino]phenyl}furan-2-carboxamide
N-{4-[({1-[(4-methylphenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene}methyl)amino]phenyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | C200-4126 |
| Compound Name: | N-{4-[({1-[(4-methylphenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene}methyl)amino]phenyl}furan-2-carboxamide |
| Molecular Weight: | 513.57 |
| Molecular Formula: | C28 H23 N3 O5 S |
| Smiles: | Cc1ccc(CN2c3ccccc3C(/C(=C\Nc3ccc(cc3)NC(c3ccco3)=O)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5392 |
| logD: | 4.5392 |
| logSw: | -4.4204 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.179 |
| InChI Key: | ZGMUYVPAKBTWDK-UHFFFAOYSA-N |