N-[3-(butylsulfanyl)propyl]-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
N-[3-(butylsulfanyl)propyl]-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide
Compound characteristics
| Compound ID: | K788-5454 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-2-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl}propanamide |
| Molecular Weight: | 484.72 |
| Molecular Formula: | C27 H36 N2 O2 S2 |
| Smiles: | CCCCSCCCNC(C(C)C1C(N(Cc2cc(C)ccc2C)c2ccccc2S1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0087 |
| logD: | 6.0087 |
| logSw: | -5.2868 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.868 |
| InChI Key: | NFGVNECOGHFPBO-UHFFFAOYSA-N |