![Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine structure](/static/products/7529/752919-84-9.webp)
Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine
TL;DR: Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine (CAS 752919-84-9) is a chemical compound with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,8aS)-1-(4-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine
Also Known As: (6S,7S)-7-(4-chlorophenyl)-8-oxa-1-azabicyclo[4.3.0]nonan-9-imine, (1R,8aS)-1-(4-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine, Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine
| Molecular Formula | C13H15ClN2O |
|---|---|
| Molecular Weight | 250.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.0873 |
| Heavy Atoms | 17 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 752919-84-9 |
|---|---|
| SMILES | C1CCN2[C@@H](C1)[C@H](OC2=N)C3=CC=C(C=C3)Cl |
| InChIKey | DXTLMQQPKGLPMB-NWDGAFQWSA-N |
Product Overview
Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine (CAS 752919-84-9), with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol. IUPAC: (1R,8aS)-1-(4-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine.
Chemical Property Profile of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine
Property Insights of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine
The XLogP value of 3.1 indicates that Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.3 Ų, Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine 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 Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine?
The CAS number of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine is 752919-84-9.
What is the molecular formula of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine?
The molecular formula of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine is C13H15ClN2O.
What is the molecular weight of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine?
The molecular weight of Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine is 250.09 g/mol.
Where can I buy Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine?
You can request a quote for Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine?
Yes, KEHONG BIO provides custom synthesis services for Rel-(1R,8aS)-1-(4-chlorophenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.