1-acetyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinolin-7-yl 4-chlorobenzoate
Chemical Structure Depiction of
1-acetyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinolin-7-yl 4-chlorobenzoate
1-acetyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinolin-7-yl 4-chlorobenzoate
Compound characteristics
| Compound ID: | Y021-3504 |
| Compound Name: | 1-acetyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinolin-7-yl 4-chlorobenzoate |
| Molecular Weight: | 447.96 |
| Molecular Formula: | C27 H26 Cl N O3 |
| Smiles: | CC(N1c2cc(ccc2C(C)(CC1(C)C)c1ccccc1)OC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9419 |
| logD: | 5.9419 |
| logSw: | -6.0105 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.17 |
| InChI Key: | ORNFGIKIYUMUEP-MHZLTWQESA-N |