N-[(2-chloro-4-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
N-[(2-chloro-4-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Compound characteristics
| Compound ID: | P563-1550 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide |
| Molecular Weight: | 406.86 |
| Molecular Formula: | C19 H16 Cl F N2 O3 S |
| Smiles: | C1CC2=C(C(NCc3ccc(cc3[Cl])F)=O)S(c3ccccc3N2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3464 |
| logD: | 3.3461 |
| logSw: | -3.6194 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.426 |
| InChI Key: | GPFWCAWAJNNZQF-UHFFFAOYSA-N |