N-(4-ethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide
N-(4-ethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide
Compound characteristics
| Compound ID: | E699-2369 |
| Compound Name: | N-(4-ethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)butanamide |
| Molecular Weight: | 418.53 |
| Molecular Formula: | C20 H22 N2 O4 S2 |
| Smiles: | CCc1ccc(cc1)NC(CC(C)S(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.949 |
| logD: | 2.9489 |
| logSw: | -3.4628 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.709 |
| InChI Key: | INVQTLILSPVXRU-ZDUSSCGKSA-N |