N-{2-[({1-[(3-fluorophenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene}methyl)amino]ethyl}acetamide
Chemical Structure Depiction of
N-{2-[({1-[(3-fluorophenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene}methyl)amino]ethyl}acetamide
N-{2-[({1-[(3-fluorophenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene}methyl)amino]ethyl}acetamide
Compound characteristics
| Compound ID: | E953-0474 |
| Compound Name: | N-{2-[({1-[(3-fluorophenyl)methyl]-2,2,4-trioxo-1,4-dihydro-2lambda~6~-thieno[3,2-c][1,2]thiazin-3(2H)-ylidene}methyl)amino]ethyl}acetamide |
| Molecular Weight: | 423.48 |
| Molecular Formula: | C18 H18 F N3 O4 S2 |
| Smiles: | CC(NCCN/C=C1/C(c2c(ccs2)N(Cc2cccc(c2)F)S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8757 |
| logD: | 0.8757 |
| logSw: | -2.3718 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.598 |
| InChI Key: | ULUTUHGSSKVFKX-UHFFFAOYSA-N |