N-{3-[butyl(phenyl)amino]propyl}-4-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-{3-[butyl(phenyl)amino]propyl}-4-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-{3-[butyl(phenyl)amino]propyl}-4-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K784-8555 |
| Compound Name: | N-{3-[butyl(phenyl)amino]propyl}-4-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 540.1 |
| Molecular Formula: | C29 H31 Cl F N3 O2 S |
| Smiles: | CCCCN(CCCNC(c1ccc2c(c1)N(Cc1c(cccc1[Cl])F)C(CS2)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0653 |
| logD: | 6.0401 |
| logSw: | -5.9703 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.117 |
| InChI Key: | NSFSOZRJWIZFGO-UHFFFAOYSA-N |