methyl 6-chloro-2-[2-(2,6-dimethylanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Chemical Structure Depiction of
methyl 6-chloro-2-[2-(2,6-dimethylanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
methyl 6-chloro-2-[2-(2,6-dimethylanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Compound characteristics
| Compound ID: | F419-0102 |
| Compound Name: | methyl 6-chloro-2-[2-(2,6-dimethylanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate |
| Molecular Weight: | 511 |
| Molecular Formula: | C26 H23 Cl N2 O5 S |
| Smiles: | Cc1cccc(C)c1NC(CN1C(=C(c2ccccc2)c2cc(ccc2S1(=O)=O)[Cl])C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2204 |
| logD: | 5.2204 |
| logSw: | -5.5441 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.328 |
| InChI Key: | NARATZYCCUMNEX-UHFFFAOYSA-N |