N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide
N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide
Compound characteristics
| Compound ID: | E953-0075 |
| Compound Name: | N-(4-{[(1-benzyl-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene)methyl]amino}phenyl)acetamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C22 H19 N3 O4 S2 |
| Smiles: | CC(Nc1ccc(cc1)N/C=C1/C(c2c(ccs2)N(Cc2ccccc2)S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.312 |
| logD: | 3.312 |
| logSw: | -3.8393 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.79 |
| InChI Key: | HVUOTKNNCMBFJV-UHFFFAOYSA-N |