trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide
TL;DR: trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide (CAS 75343-67-8) is a chemical compound with molecular formula C13H16BrClN2O and molecular weight 330.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,8aR)-1-(3-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine;hydrobromide
Also Known As: trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide, 3H-Oxazolo(3,4-a)pyridine, hexahydro-1-(m-chlorophenyl)-3-imino-, hydrobromide (E)-, (1R,8aR)-1-(3-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide, (1R,8aR)-1-(3-Chlorophenyl)hexahydro-3H-[1,3]oxazolo[3,4-a]pyridin-3-imine--hydrogen bromide (1/1), 1-(3-Chlorophenyl)hexahydro-3H-[1,3]oxazolo[3,4-a]pyridin-3-imine--hydrogen bromide (1/1)
| Molecular Formula | C13H16BrClN2O |
|---|---|
| Molecular Weight | 330.01 g/mol |
| LogP | 3.77847 |
| Topological Polar Surface Area | 36.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.01346 |
| Heavy Atoms | 18 |
| Complexity | 454.3723 |
Chemical Identifiers
| CAS Number | 75343-67-8 |
|---|---|
| SMILES | C1CCN2[C@H](C1)[C@H](OC2=N)C3=CC(=CC=C3)Cl.Br |
Product Overview
trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide (CAS 75343-67-8), with molecular formula C13H16BrClN2O and molecular weight 330.01 g/mol. IUPAC: (1R,8aR)-1-(3-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine;hydrobromide.
Chemical Property Profile of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide
Property Insights of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide
The XLogP value of 3.77847 indicates that trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.32 Ų, trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide has 1 hydrogen bond donor(s) and 2 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 trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide?
The CAS number of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide is 75343-67-8.
What is the molecular formula of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide?
The molecular formula of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide is C13H16BrClN2O.
What is the molecular weight of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide?
The molecular weight of trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide is 330.01 g/mol.
Where can I buy trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide?
You can request a quote for trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for trans-1-(m-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.