AC1Q3BCE
3-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(2,6-dichlorophenyl)propanamide;hydrochloride
Also Known As: 4-morpholin-4-ylbutanoic acid,hydrochloride|trans-N-(2,6-Dichlorophenyl)octahydro-1(2H)-quinolinepropanamide monohydrochloride|1(2H)-Quinolinepropanamide, N-(2,6-dichlorophenyl)octahydro-, monohydrochloride, trans-|1 -Quinolinepropanamide,N- octahydro-,monohydrochloride,trans-|N-(2,6-Dichlorophenyl)-3-[(4aR,8aS)-octahydro-1(2H)-quinolinyl]propanamide hydrochloride|3-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(2,6-dichlorophenyl)propanamide hydrochloride|N-(2,6-Dichlorophenyl)-3-(octahydroquinolin-1(2H)-yl)propanimidic acid--hydrogen chloride (1/1)|n-(2,6-dichlorophenyl)-3-[(4ar,8as)-octahydroquinolin-1(2h)-yl]propanamide hydrochloride(1:1)|N-(2,6-Dichlorophenyl)-3-[(4aR,8aS)-octahydro-1(2H)-quinolinyl]pr opanamide hydrochloride (1:1)|N-(2,6-Dichlorophenyl)-3-[(4aR,8aS)-octahydroquinolin-1(2H)-yl]propanimidic acid--hydrogen chloride (1/1)
| Molecular Formula | C18H25Cl3N2O |
|---|---|
| Molecular Weight | 390.10324 g/mol |
| LogP | 5.3984 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.10324 |
| Monoisotopic Mass | 390.10324 |
| Heavy Atoms | 24 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 516-78-9 |
|---|---|
| SMILES | C1CC[C@H]2[C@H](C1)CCCN2CCC(=O)NC3=C(C=CC=C3Cl)Cl.Cl |
| InChIKey | VIDFKXOLJFMNTC-CACIRBSMSA-N |
Product Overview
AC1Q3BCE (CAS 516-78-9), with molecular formula C18H25Cl3N2O and molecular weight 390.10324 g/mol. IUPAC: 3-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(2,6-dichlorophenyl)propanamide;hydrochloride.
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