2-benzylidene-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-benzylidene-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-benzylidene-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K788-9715 |
| Compound Name: | 2-benzylidene-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 511.69 |
| Molecular Formula: | C31 H33 N3 O2 S |
| Smiles: | CCN1CCCC1CNC(c1ccc2c(c1)N(Cc1cccc(C)c1)C(/C(=C/c1ccccc1)S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8855 |
| logD: | 5.3451 |
| logSw: | -5.4143 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.39 |
| InChI Key: | KWPZNKJRBDWMGN-AREMUKBSSA-N |