3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methylidene)-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methylidene)-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methylidene)-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0456 |
| Compound Name: | 3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methylidene)-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 502.58 |
| Molecular Formula: | C24 H23 F N2 O5 S2 |
| Smiles: | COc1ccc(CCN/C=C2/C(c3c(ccs3)N(Cc3cccc(c3)F)S2(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0256 |
| logD: | 3.0256 |
| logSw: | -3.5888 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.161 |
| InChI Key: | PRVVBTAXJNJEIG-UHFFFAOYSA-N |