methyl 6-[2-(3,5-dimethyladamantan-1-yl)acetamido]-3,4-dihydroquinoline-1(2H)-carboxylate
Chemical Structure Depiction of
methyl 6-[2-(3,5-dimethyladamantan-1-yl)acetamido]-3,4-dihydroquinoline-1(2H)-carboxylate
methyl 6-[2-(3,5-dimethyladamantan-1-yl)acetamido]-3,4-dihydroquinoline-1(2H)-carboxylate
Compound characteristics
| Compound ID: | 8019-0504 |
| Compound Name: | methyl 6-[2-(3,5-dimethyladamantan-1-yl)acetamido]-3,4-dihydroquinoline-1(2H)-carboxylate |
| Molecular Weight: | 410.56 |
| Molecular Formula: | C25 H34 N2 O3 |
| Smiles: | CC12CC3CC(C)(C1)CC(C3)(CC(Nc1ccc3c(CCCN3C(=O)OC)c1)=O)C2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.911 |
| logD: | 4.911 |
| logSw: | -4.6317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.207 |
| InChI Key: | KXTKHVFTXXIWNP-UHFFFAOYSA-N |