N-cyclooctyl-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Chemical Structure Depiction of
N-cyclooctyl-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
N-cyclooctyl-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Compound characteristics
| Compound ID: | C493-1074 |
| Compound Name: | N-cyclooctyl-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide |
| Molecular Weight: | 464.67 |
| Molecular Formula: | C28 H36 N2 O2 S |
| Smiles: | CC(C1C(N(Cc2cc(C)ccc2C)c2ccccc2S1)=O)C(NC1CCCCCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.8916 |
| logD: | 6.8916 |
| logSw: | -5.459 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.811 |
| InChI Key: | NAANXABMTWQPLG-UHFFFAOYSA-N |