N-(3-fluoro-4-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide
N-(3-fluoro-4-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide
Compound characteristics
| Compound ID: | E699-2455 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C19 H19 F N2 O4 S2 |
| Smiles: | CC(CC(Nc1ccc(C)c(c1)F)=O)S(c1ccc2c(c1)NC(CS2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6681 |
| logD: | 2.6652 |
| logSw: | -3.119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.709 |
| InChI Key: | ABTHKBCRJFNXKO-LBPRGKRZSA-N |