methyl 4-chloro-3-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-chloro-3-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
methyl 4-chloro-3-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | D289-0437 |
| Compound Name: | methyl 4-chloro-3-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate |
| Molecular Weight: | 484.96 |
| Molecular Formula: | C24 H21 Cl N2 O5 S |
| Smiles: | CCc1ccc2c(c1)c1ccccc1S(N2CC(Nc1cc(ccc1[Cl])C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1433 |
| logD: | 5.1428 |
| logSw: | -5.4829 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.387 |
| InChI Key: | PCUIHHQVXRAUJI-UHFFFAOYSA-N |