8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate
Chemical Structure Depiction of
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate
Compound characteristics
| Compound ID: | Y041-2471 |
| Compound Name: | 8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate |
| Molecular Weight: | 441.87 |
| Molecular Formula: | C23 H20 Cl N O6 |
| Smiles: | C[C@@H](C(=O)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2)NC(=O)OCc1ccccc1 |
| Stereo: | ABSOLUTE |
| logP: | 4.4954 |
| logD: | 4.4954 |
| logSw: | -4.7674 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.216 |
| InChI Key: | BVTCJUGRWRCLKU-ZDUSSCGKSA-N |