3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate
Chemical Structure Depiction of
3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate
3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate
Compound characteristics
Compound ID: | Y041-1592 |
Compound Name: | 3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate |
Molecular Weight: | 547.67 |
Molecular Formula: | C31 H33 N O6 S |
Smiles: | CC(C)C[C@@H](C(=O)Oc1ccc2C(C)=C(Cc3ccccc3)C(=O)Oc2c1C)NS(c1ccc(C)cc1)(=O)=O |
Stereo: | ABSOLUTE |
logP: | 6.9015 |
logD: | 6.9014 |
logSw: | -5.7868 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.911 |
InChI Key: | HZARIOYAWMEIRV-MHZLTWQESA-N |