N-[3-(cyclohexylsulfanyl)propyl]-2-{4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-2-{4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
N-[3-(cyclohexylsulfanyl)propyl]-2-{4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Compound characteristics
| Compound ID: | K788-1181 |
| Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-2-{4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide |
| Molecular Weight: | 480.69 |
| Molecular Formula: | C27 H32 N2 O2 S2 |
| Smiles: | Cc1ccccc1CN1C(/C(=C/C(NCCCSC2CCCCC2)=O)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3346 |
| logD: | 6.3346 |
| logSw: | -5.3288 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.575 |
| InChI Key: | YPAMECSUTDLHJF-UHFFFAOYSA-N |