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 |