6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
Chemical Structure Depiction of
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
Compound characteristics
| Compound ID: | Y041-3001 |
| Compound Name: | 6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate |
| Molecular Weight: | 519.98 |
| Molecular Formula: | C29 H26 Cl N O6 |
| Smiles: | C(CCC(=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1)CCNC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6346 |
| logD: | 5.6346 |
| logSw: | -5.991 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.227 |
| InChI Key: | MMONIHIBWDIHHW-UHFFFAOYSA-N |