3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[4-(propan-2-yl)phenyl]butanamide
Chemical Structure Depiction of
3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[4-(propan-2-yl)phenyl]butanamide
3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[4-(propan-2-yl)phenyl]butanamide
Compound characteristics
| Compound ID: | E667-1149 |
| Compound Name: | 3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[4-(propan-2-yl)phenyl]butanamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | CC(C)c1ccc(cc1)NC(CC(C)S(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8867 |
| logD: | 2.8866 |
| logSw: | -3.504 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.159 |
| InChI Key: | KLOMENZKRAARMY-AWEZNQCLSA-N |