methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-4-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]-4-methylbenzoate
methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-4-methylbenzoate
Compound characteristics
| Compound ID: | J097-0305 |
| Compound Name: | methyl 3-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]-4-methylbenzoate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C24 H22 N2 O5 S |
| Smiles: | CCN1c2ccc(cc2c2ccccc2S1(=O)=O)C(Nc1cc(ccc1C)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.244 |
| logD: | 4.2437 |
| logSw: | -4.2386 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.326 |
| InChI Key: | GXYXOGSYPAXQBH-UHFFFAOYSA-N |