ethyl 6-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate
Chemical Structure Depiction of
ethyl 6-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate
ethyl 6-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate
Compound characteristics
| Compound ID: | Y020-6184 |
| Compound Name: | ethyl 6-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate |
| Molecular Weight: | 370.85 |
| Molecular Formula: | C16 H19 Cl N2 O4 S |
| Smiles: | CCOC(C1CSC(CC(Nc2cc(ccc2C)[Cl])=O)C(N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6655 |
| logD: | 1.665 |
| logSw: | -2.7811 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.875 |
| InChI Key: | JRQZSGZHVJWEBO-UHFFFAOYSA-N |