2-benzylidene-6-(4-benzylpiperidine-1-carbonyl)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-benzylidene-6-(4-benzylpiperidine-1-carbonyl)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-benzylidene-6-(4-benzylpiperidine-1-carbonyl)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
Compound ID: | K788-8718 |
Compound Name: | 2-benzylidene-6-(4-benzylpiperidine-1-carbonyl)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
Molecular Weight: | 562.71 |
Molecular Formula: | C35 H31 F N2 O2 S |
Smiles: | C1CN(CCC1Cc1ccccc1)C(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(/C(=C/c1ccccc1)S2)=O)=O |
Stereo: | ACHIRAL |
logP: | 7.5746 |
logD: | 7.5746 |
logSw: | -6.2628 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 31.4463 |
InChI Key: | HIZAPURYAIXPOV-UHFFFAOYSA-N |