2-benzylidene-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-benzylidene-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-benzylidene-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C700-0829 |
Compound Name: | 2-benzylidene-N-[3-(2-ethylpiperidin-1-yl)propyl]-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 553.77 |
Molecular Formula: | C34 H39 N3 O2 S |
Smiles: | CCC1CCCCN1CCCNC(c1ccc2c(c1)N(Cc1cccc(C)c1)C(/C(=C\c1ccccc1)S2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.9079 |
logD: | 4.041 |
logSw: | -5.5826 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 43.119 |
InChI Key: | PQNCFFTXZAKQAX-LJAQVGFWSA-N |