methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-2-methylbenzoate
Chemical Structure Depiction of
methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-2-methylbenzoate
methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-2-methylbenzoate
Compound characteristics
| Compound ID: | J097-0331 |
| Compound Name: | methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-2-methylbenzoate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C24 H22 N2 O5 S |
| Smiles: | CCN1c2ccc(cc2c2ccccc2S1(=O)=O)C(Nc1cccc(C(=O)OC)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1821 |
| logD: | 4.1819 |
| logSw: | -4.2636 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.326 |
| InChI Key: | OYFQXCDPMLDXPX-UHFFFAOYSA-N |