methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-4H-3,1-benzothiazine-7-carboxylate
Chemical Structure Depiction of
methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-4H-3,1-benzothiazine-7-carboxylate
methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-4H-3,1-benzothiazine-7-carboxylate
Compound characteristics
| Compound ID: | 8018-3365 |
| Compound Name: | methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-4H-3,1-benzothiazine-7-carboxylate |
| Molecular Weight: | 399.44 |
| Molecular Formula: | C20 H18 F N3 O3 S |
| Smiles: | COC(c1ccc2C(=O)SC(=Nc2c1)N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0096 |
| logD: | 4.0096 |
| logSw: | -4.2586 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.214 |
| InChI Key: | ZZSNEDDXGMAXIU-UHFFFAOYSA-N |