![5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide structure](/static/products/179/179872-27-6.png)
5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide
TL;DR: 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide (CAS 179872-27-6) is a chemical compound with molecular formula C15H18ClIN2O2 and molecular weight 418.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-5-chloro-3-(125I)iodo-2-methoxy(125I)benzamide
Also Known As: 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide, N-[(8R)-1-azabicyclo[2.2.2]oct-8-yl]-5-chloro-3-iodo-2-methoxy-benzamide
| Molecular Formula | C15H18ClIN2O2 |
|---|---|
| Molecular Weight | 418.01 g/mol |
| LogP | 2.7772 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.0103 |
| Heavy Atoms | 21 |
| Complexity | 558.84973 |
Chemical Identifiers
| CAS Number | 179872-27-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1[125I])Cl)C(=O)N[C@@H]2CN3CCC2CC3 |
Product Overview
5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide (CAS 179872-27-6), with molecular formula C15H18ClIN2O2 and molecular weight 418.01 g/mol. IUPAC: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-5-chloro-3-(125I)iodo-2-methoxy(125I)benzamide.
Chemical Property Profile of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide
Property Insights of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide
The XLogP value of 2.7772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide. With a topological polar surface area (TPSA) of 41.57 Ų, 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide has 1 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 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide?
The CAS number of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide is 179872-27-6.
What is the molecular formula of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide?
The molecular formula of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide is C15H18ClIN2O2.
What is the molecular weight of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide?
The molecular weight of 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide is 418.01 g/mol.
Where can I buy 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide?
You can request a quote for 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-3-(125iodo)-2-methoxy-n-[3(s)-quinuclidinyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.