N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C122-0712 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 480.56 |
| Molecular Formula: | C26 H25 F N2 O4 S |
| Smiles: | COc1ccc(CCNC(c2ccc3c(c2)N(Cc2ccccc2F)C(CS3)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5606 |
| logD: | 3.5606 |
| logSw: | -3.9118 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.134 |
| InChI Key: | PZZALMVIRCCTJE-UHFFFAOYSA-N |