4-(3,4-dimethoxyphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-(3,4-dimethoxyphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-(3,4-dimethoxyphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0396 |
| Compound Name: | 4-(3,4-dimethoxyphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 432.47 |
| Molecular Formula: | C21 H21 F N2 O5 S |
| Smiles: | COc1ccc(cc1OC)N1C=C(C(N2CCCC2)=O)S(c2ccc(cc12)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0715 |
| logD: | 2.0715 |
| logSw: | -2.7468 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.226 |
| InChI Key: | FEQHZHQYGUCYFV-UHFFFAOYSA-N |