4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K784-8559 |
| Compound Name: | 4-[(2-chloro-6-fluorophenyl)methyl]-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 587.54 |
| Molecular Formula: | C29 H29 Cl2 F N4 O2 S |
| Smiles: | C(CNC(c1ccc2c(c1)N(Cc1c(cccc1[Cl])F)C(CS2)=O)=O)CN1CCN(CC1)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9546 |
| logD: | 4.4108 |
| logSw: | -5.0617 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.117 |
| InChI Key: | LWXMOXGWRANYBK-UHFFFAOYSA-N |