N-[(2-chlorophenyl)methyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
N-[(2-chlorophenyl)methyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Compound characteristics
| Compound ID: | C493-0594 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide |
| Molecular Weight: | 468.98 |
| Molecular Formula: | C25 H22 Cl F N2 O2 S |
| Smiles: | CC(C1C(N(Cc2ccc(cc2)F)c2ccccc2S1)=O)C(NCc1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0679 |
| logD: | 5.0679 |
| logSw: | -5.2308 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.754 |
| InChI Key: | IGAUWTRDCUULRF-UHFFFAOYSA-N |