3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate
Chemical Structure Depiction of
3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate
3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate
Compound characteristics
| Compound ID: | Y041-1682 |
| Compound Name: | 3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate |
| Molecular Weight: | 483.95 |
| Molecular Formula: | C26 H26 Cl N O6 |
| Smiles: | CC1=C(C(=O)Oc2cc(ccc12)OC(C1CCC(CC1)CNC(=O)OCc1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5658 |
| logD: | 5.5658 |
| logSw: | -5.9147 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.6 |
| InChI Key: | FYYZBOFNEBRJSL-UHFFFAOYSA-N |