N-[1-(3,4-dimethoxyphenyl)ethyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Chemical Structure Depiction of
N-[1-(3,4-dimethoxyphenyl)ethyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
N-[1-(3,4-dimethoxyphenyl)ethyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Compound characteristics
| Compound ID: | P563-1103 |
| Compound Name: | N-[1-(3,4-dimethoxyphenyl)ethyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide |
| Molecular Weight: | 446.5 |
| Molecular Formula: | C22 H23 F N2 O5 S |
| Smiles: | CC(c1ccc(c(c1)OC)OC)NC(C1=C2CCCN2c2ccc(cc2S1(=O)=O)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.704 |
| logD: | 2.704 |
| logSw: | -3.3909 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.85 |
| InChI Key: | LVGPKQSAEDTVFP-ZDUSSCGKSA-N |