methyl 4-chloro-3-[(6,7-dimethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-chloro-3-[(6,7-dimethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]benzoate
methyl 4-chloro-3-[(6,7-dimethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | J097-0706 |
| Compound Name: | methyl 4-chloro-3-[(6,7-dimethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carbonyl)amino]benzoate |
| Molecular Weight: | 470.93 |
| Molecular Formula: | C23 H19 Cl N2 O5 S |
| Smiles: | Cc1cc(cc2c3ccccc3S(N(C)c12)(=O)=O)C(Nc1cc(ccc1[Cl])C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4244 |
| logD: | 5.3918 |
| logSw: | -5.8702 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.763 |
| InChI Key: | YIQURJGQFFBTJH-UHFFFAOYSA-N |