3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
Chemical Structure Depiction of
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
Compound characteristics
| Compound ID: | Y041-1413 |
| Compound Name: | 3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate |
| Molecular Weight: | 513.59 |
| Molecular Formula: | C31 H31 N O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OC(CCCCCNC(=O)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8578 |
| logD: | 5.8578 |
| logSw: | -5.4584 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.654 |
| InChI Key: | DUHGKWRHNFJXPS-UHFFFAOYSA-N |