4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K784-8553 |
| Compound Name: | 4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 526.07 |
| Molecular Formula: | C28 H29 Cl F N3 O2 S |
| Smiles: | CCN(CCCNC(c1ccc2c(c1)N(Cc1c(cccc1[Cl])F)C(CS2)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5938 |
| logD: | 5.5654 |
| logSw: | -5.8336 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.864 |
| InChI Key: | FQJWIUCUMDLHOH-UHFFFAOYSA-N |