N-[(4-ethoxyphenyl)methyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
N-[(4-ethoxyphenyl)methyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Compound characteristics
| Compound ID: | P563-1046 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-7-fluoro-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide |
| Molecular Weight: | 416.47 |
| Molecular Formula: | C21 H21 F N2 O4 S |
| Smiles: | CCOc1ccc(CNC(C2=C3CCCN3c3ccc(cc3S2(=O)=O)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9571 |
| logD: | 2.957 |
| logSw: | -3.6026 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.55 |
| InChI Key: | RTTQCXCCMFJYEQ-UHFFFAOYSA-N |