RefChem:1067348
TL;DR: RefChem:1067348 (CAS 73855-69-3) is a chemical compound with molecular formula C22H30ClNOS and molecular weight 391.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-azoniabicyclo[3.2.2]nonan-3-yl)-1-phenyl-2-thiophen-2-ylbutan-2-ol chloride
Also Known As: 3-Azabicyclo(3.2.2)nonane-3-propanol, alpha-benzyl-alpha-(2-thienyl)-, hydrochloride, alpha-Benzyl-alpha-(2-thienyl)-3-azabicyclo(3.2.2)nonane-3-propanol hydrochloride, 3-Azabicyclo(3.2.2)nonane-3-propanol, alpha-(phenylmethyl)-alpha-2-thienyl-, hydrochloride, 4-(3-azoniabicyclo[3.2.2]nonan-3-yl)-1-phenyl-2-thiophen-2-ylbutan-2-ol chloride, 3-Azabicyclo[3.2.2]nonane-3-propanol, .alpha.-(phenylmethyl)-.alpha.-2-thienyl-, hydrochloride
| Molecular Formula | C22H30ClNOS |
|---|---|
| Molecular Weight | 391.17 g/mol |
| LogP | 0.28 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.17368 |
| Heavy Atoms | 26 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 73855-69-3 |
|---|---|
| SMILES | C1CC2CCC1C[NH+](C2)CCC(CC3=CC=CC=C3)(C4=CC=CS4)O.[Cl-] |
| InChIKey | ADQQWPNWZYNRTO-UHFFFAOYSA-N |
Product Overview
RefChem:1067348 (CAS 73855-69-3), with molecular formula C22H30ClNOS and molecular weight 391.17 g/mol. IUPAC: 4-(3-azoniabicyclo[3.2.2]nonan-3-yl)-1-phenyl-2-thiophen-2-ylbutan-2-ol chloride.
Chemical Property Profile of RefChem:1067348
Property Insights of RefChem:1067348
The XLogP value of 0.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1067348. With a topological polar surface area (TPSA) of 52.9 Ų, RefChem:1067348 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1067348 has 2 hydrogen bond donor(s) and 3 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 RefChem:1067348?
The CAS number of RefChem:1067348 is 73855-69-3.
What is the molecular formula of RefChem:1067348?
The molecular formula of RefChem:1067348 is C22H30ClNOS.
What is the molecular weight of RefChem:1067348?
The molecular weight of RefChem:1067348 is 391.17 g/mol.
Where can I buy RefChem:1067348?
You can request a quote for RefChem:1067348 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1067348?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1067348 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.