methyl 2-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
methyl 2-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-0869 |
| Compound Name: | methyl 2-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 379.43 |
| Molecular Formula: | C17 H21 N3 O5 S |
| Smiles: | CCN(C(CN1C=C(C(C)=NS1(=O)=O)C(=O)OC)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.2448 |
| logD: | 1.2448 |
| logSw: | -2.377 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.764 |
| InChI Key: | CJBHIACHZOFJOD-UHFFFAOYSA-N |