4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}benzene-1-sulfonamide
Chemical Structure Depiction of
4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}benzene-1-sulfonamide
4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E745-0090 |
| Compound Name: | 4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}benzene-1-sulfonamide |
| Molecular Weight: | 469.54 |
| Molecular Formula: | C22 H19 N3 O5 S2 |
| Smiles: | C(c1ccccc1)N1c2ccccc2C(/C(=C\Nc2ccc(cc2)S(N)(=O)=O)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3729 |
| logD: | 2.3683 |
| logSw: | -3.1633 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.113 |
| InChI Key: | UEPFOGSACCGWHY-UHFFFAOYSA-N |