7-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-9-yl 2-{[(benzyloxy)carbonyl]amino}butanoate
Chemical Structure Depiction of
7-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-9-yl 2-{[(benzyloxy)carbonyl]amino}butanoate
7-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-9-yl 2-{[(benzyloxy)carbonyl]amino}butanoate
Compound characteristics
| Compound ID: | Y041-1666 |
| Compound Name: | 7-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-9-yl 2-{[(benzyloxy)carbonyl]amino}butanoate |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C25 H25 N O6 |
| Smiles: | CCC(C(=O)Oc1cc(C)cc2c1C1CCCC=1C(=O)O2)NC(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0537 |
| logD: | 5.0537 |
| logSw: | -5.0731 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.683 |
| InChI Key: | UAPIBKCVZHHLAR-IBGZPJMESA-N |