methyl 6-bromo-1,1-dioxo-4-(4-phenoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 6-bromo-1,1-dioxo-4-(4-phenoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 6-bromo-1,1-dioxo-4-(4-phenoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | G917-0232 |
| Compound Name: | methyl 6-bromo-1,1-dioxo-4-(4-phenoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 486.34 |
| Molecular Formula: | C22 H16 Br N O5 S |
| Smiles: | COC(C1=CN(c2ccc(cc2)Oc2ccccc2)c2cc(ccc2S1(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6513 |
| logD: | 4.6513 |
| logSw: | -4.5704 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.872 |
| InChI Key: | KKCLXFXHCDVYBS-UHFFFAOYSA-N |