dimethyl 5-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y205-0199 |
| Compound Name: | dimethyl 5-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 421.83 |
| Molecular Formula: | C19 H13 Cl F N O5 S |
| Smiles: | COC(c1cc(cc(c1)NC(c1c(c2ccc(cc2s1)F)[Cl])=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3616 |
| logD: | 5.36 |
| logSw: | -6.1212 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.424 |
| InChI Key: | JCEOWFSMINGYRP-UHFFFAOYSA-N |