碘苄胍
TL;DR: 碘苄胍 (CAS 77679-27-7) is a chemical compound with molecular formula C8H10IN3 and molecular weight 278.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
碘苄胍
2-[(3-(131I)iodophenyl)methyl]guanidine
Also Known As: Iobenguane I 131, Iobenguane (131I), Azedra, Iobeguane I 131, Iobenguane I131
| Molecular Formula | C8H10IN3 |
|---|---|
| Molecular Weight | 278.99 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.9936 |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 77679-27-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[131I])CN=C(N)N |
| InChIKey | PDWUPXJEEYOOTR-JRGAVVOBSA-N |
Product Overview
碘苄胍 (CAS 77679-27-7), with molecular formula C8H10IN3 and molecular weight 278.99 g/mol. IUPAC: 2-[(3-(131I)iodophenyl)methyl]guanidine.
Chemical Property Profile of 碘苄胍
Property Insights of 碘苄胍
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 碘苄胍. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 碘苄胍. Following Lipinski's Rule of Five, 碘苄胍 has 2 hydrogen bond donor(s) and 1 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 碘苄胍?
The CAS number of 碘苄胍 is 77679-27-7.
What is the molecular formula of 碘苄胍?
The molecular formula of 碘苄胍 is C8H10IN3.
What is the molecular weight of 碘苄胍?
The molecular weight of 碘苄胍 is 278.99 g/mol.
Where can I buy 碘苄胍?
You can request a quote for 碘苄胍 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 碘苄胍?
Yes, KEHONG BIO provides custom synthesis services for 碘苄胍 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.