(1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride
TL;DR: (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride (CAS 207386-86-5) is a chemical compound with molecular formula C20H29BrN2O3 and molecular weight 424.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(S)-[(2S,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;hydrate;hydrobromide
Also Known As: Hydroquinine hydrobromide hydrate, Hydroquinine hydrobromide hydrate, 98%, (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride, - -2-AMINOCYCLOHEX-4-ENECARBOXYLICACIDHYDROCHLORIDE, (S)-[(2S,4S,5R)-5-Ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;hydrate;hydrobromide
| Molecular Formula | C20H29BrN2O3 |
|---|---|
| Molecular Weight | 424.14 g/mol |
| LogP | 3.1504 |
| Topological Polar Surface Area | 77.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.13617 |
| Heavy Atoms | 26 |
| Complexity | 742.0681 |
Chemical Identifiers
| CAS Number | 207386-86-5 |
|---|---|
| SMILES | CC[C@H]1CN2CC[C@H]1C[C@H]2[C@H](C3=C4C=C(C=CC4=NC=C3)OC)O.O.Br |
Product Overview
(1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride (CAS 207386-86-5), with molecular formula C20H29BrN2O3 and molecular weight 424.14 g/mol. IUPAC: (S)-[(2S,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;hydrate;hydrobromide.
Chemical Property Profile of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride
Property Insights of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride
The XLogP value of 3.1504 indicates that (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.09 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride. Following Lipinski's Rule of Five, (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride?
The CAS number of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride is 207386-86-5.
What is the molecular formula of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride?
The molecular formula of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride is C20H29BrN2O3.
What is the molecular weight of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride?
The molecular weight of (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride is 424.14 g/mol.
Where can I buy (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride?
You can request a quote for (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (1S,2R)-(+)-2-AMINOCYCLOHEX-4-ENECARBOXYLIC ACID hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.