N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Compound characteristics
| Compound ID: | K788-6078 |
| Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C28 H27 F N2 O4 S |
| Smiles: | CC(C1C(N(Cc2ccc(cc2)F)c2ccccc2S1)=O)C(NC(C)c1ccc2c(c1)OCCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0562 |
| logD: | 4.0562 |
| logSw: | -4.086 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.741 |
| InChI Key: | VYVFCNJGGZDQDW-UHFFFAOYSA-N |