2-benzoyl-4-(3,4,5-trimethoxyphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
2-benzoyl-4-(3,4,5-trimethoxyphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
2-benzoyl-4-(3,4,5-trimethoxyphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
Compound ID: | F390-0014 |
Compound Name: | 2-benzoyl-4-(3,4,5-trimethoxyphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
Molecular Weight: | 451.5 |
Molecular Formula: | C24 H21 N O6 S |
Smiles: | COc1cc(cc(c1OC)OC)N1C=C(C(c2ccccc2)=O)S(c2ccccc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1682 |
logD: | 3.1682 |
logSw: | -3.6377 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 67.395 |
InChI Key: | AVCAFXOJJKEKQF-UHFFFAOYSA-N |