N-[2-(3-methylphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-[2-(3-methylphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
N-[2-(3-methylphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | K788-3303 |
| Compound Name: | N-[2-(3-methylphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C25 H22 N2 O2 S |
| Smiles: | Cc1cccc(CCNC(c2ccc(\C=C3/C(Nc4ccccc4S3)=O)cc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5688 |
| logD: | 4.5688 |
| logSw: | -4.4169 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.099 |
| InChI Key: | HXDMNQHOHQVIFQ-UHFFFAOYSA-N |