2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Chemical Structure Depiction of
2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl N-[(benzyloxy)carbonyl]-beta-alaninate
2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | Y040-8062 |
| Compound Name: | 2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl N-[(benzyloxy)carbonyl]-beta-alaninate |
| Molecular Weight: | 455.89 |
| Molecular Formula: | C24 H22 Cl N O6 |
| Smiles: | C1CCC2=C(C1)C(=O)Oc1cc(c(cc12)[Cl])OC(CCNC(=O)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.818 |
| logD: | 4.818 |
| logSw: | -5.0082 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.933 |
| InChI Key: | ORPZBSJZVHLSQT-UHFFFAOYSA-N |