N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide
N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide
Compound characteristics
| Compound ID: | E745-0094 |
| Compound Name: | N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~,1-benzothiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | CC(Nc1ccc(cc1)N\C=C1/C(c2ccccc2N(Cc2ccccc2)S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2135 |
| logD: | 3.2134 |
| logSw: | -3.8983 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.771 |
| InChI Key: | OYFNNWUYWOBINB-UHFFFAOYSA-N |