2-chloro-6-ethoxy-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol
Chemical Structure Depiction of
2-chloro-6-ethoxy-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol
2-chloro-6-ethoxy-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol
Compound characteristics
Compound ID: | J038-0587 |
Compound Name: | 2-chloro-6-ethoxy-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol |
Molecular Weight: | 373.88 |
Molecular Formula: | C21 H24 Cl N O3 |
Smiles: | CCOc1cc(cc(c1O)[Cl])C1[C@@H]2CCCO[C@@H]2c2cc(C)ccc2N1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.1118 |
logD: | 5.0724 |
logSw: | -5.1693 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 43.519 |
InChI Key: | MOOKENYEKIKXLH-XTAYQOGCSA-N |