3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-
TL;DR: 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- (CAS 5583-11-9) is a chemical compound with molecular formula C13H17BrN2O and molecular weight 296.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine;hydrobromide
Also Known As: (-)-cis-3-Imino-hexahydro-1-phenyl-3H-oxazolo(3,4-a)pyridine, hydrobromide, 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-, (1R,8AR)-1-phenylhexahydro-3H-oxazolo[3,4-a]pyridin-3-imine hydrobromide, 1-Phenylhexahydro-3H-[1,3]oxazolo[3,4-a]pyridin-3-imine--hydrogen bromide (1/1), (1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide
| Molecular Formula | C13H17BrN2O |
|---|---|
| Molecular Weight | 296.05 g/mol |
| LogP | 3.12507 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.05243 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 5583-11-9 |
|---|---|
| SMILES | C1CCN2[C@H](C1)[C@H](OC2=N)C3=CC=CC=C3.Br |
| InChIKey | MDOGENWUZZTDJA-MNMPKAIFSA-N |
Product Overview
3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- (CAS 5583-11-9), with molecular formula C13H17BrN2O and molecular weight 296.05 g/mol. IUPAC: (1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine;hydrobromide.
Chemical Property Profile of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-
Property Insights of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-
The XLogP value of 3.12507 indicates that 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.3 Ų, 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- has 2 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 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-?
The CAS number of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- is 5583-11-9.
What is the molecular formula of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-?
The molecular formula of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- is C13H17BrN2O.
What is the molecular weight of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-?
The molecular weight of 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- is 296.05 g/mol.
Where can I buy 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-?
You can request a quote for 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.