ethyl 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
ethyl 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-1117 |
| Compound Name: | ethyl 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 399.85 |
| Molecular Formula: | C16 H18 Cl N3 O5 S |
| Smiles: | CCOC(C1=CN(CC(Nc2cccc(c2C)[Cl])=O)S(N=C1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8712 |
| logD: | 1.871 |
| logSw: | -2.8223 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.704 |
| InChI Key: | ZEFNQTHVUWZZKN-UHFFFAOYSA-N |