S-(2-{[6-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl) ethanethioate
Chemical Structure Depiction of
S-(2-{[6-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl) ethanethioate
S-(2-{[6-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl) ethanethioate
Compound characteristics
| Compound ID: | C321-0019 |
| Compound Name: | S-(2-{[6-fluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl) ethanethioate |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C14 H15 F N2 O3 S2 |
| Smiles: | CC(=O)SCC(/N=C1/N(CCOC)c2ccc(cc2S1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0548 |
| logD: | 2.0548 |
| logSw: | -2.5032 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 47.269 |
| InChI Key: | OHUXDMQVIFMYNE-UHFFFAOYSA-N |