2-{4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}-N-[2-(3-methylphenyl)ethyl]propanamide
Chemical Structure Depiction of
2-{4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}-N-[2-(3-methylphenyl)ethyl]propanamide
2-{4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}-N-[2-(3-methylphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | K788-4380 |
| Compound Name: | 2-{4-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}-N-[2-(3-methylphenyl)ethyl]propanamide |
| Molecular Weight: | 497.03 |
| Molecular Formula: | C27 H26 Cl F N2 O2 S |
| Smiles: | CC(C1C(N(Cc2ccc(cc2[Cl])F)c2ccccc2S1)=O)C(NCCc1cccc(C)c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7458 |
| logD: | 5.7458 |
| logSw: | -5.8227 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.596 |
| InChI Key: | LQKWLWJIDAIXGK-UHFFFAOYSA-N |