Iodoantipyrine I 131
TL;DR: Iodoantipyrine I 131 (CAS 3791-63-7) is a chemical compound with molecular formula C11H11IN2O and molecular weight 317.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(131I)iodo-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: Iodoantipyrine I 131, iodoantipyrine i-131, iodoantipyrine-i131, Iodoantipyrine, i-131, Iodoantipyrine I 131 [USAN]
| Molecular Formula | C11H11IN2O |
|---|---|
| Molecular Weight | 317.99 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 317.99326 |
| Heavy Atoms | 15 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 3791-63-7 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)[131I] |
| InChIKey | ZZOBLCHCPLOXCE-HJSJVHDISA-N |
Product Overview
Iodoantipyrine I 131 (CAS 3791-63-7), with molecular formula C11H11IN2O and molecular weight 317.99 g/mol. IUPAC: 4-(131I)iodo-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of Iodoantipyrine I 131
Property Insights of Iodoantipyrine I 131
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iodoantipyrine I 131. With a topological polar surface area (TPSA) of 23.6 Ų, Iodoantipyrine I 131 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Iodoantipyrine I 131 has 0 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 Iodoantipyrine I 131?
The CAS number of Iodoantipyrine I 131 is 3791-63-7.
What is the molecular formula of Iodoantipyrine I 131?
The molecular formula of Iodoantipyrine I 131 is C11H11IN2O.
What is the molecular weight of Iodoantipyrine I 131?
The molecular weight of Iodoantipyrine I 131 is 317.99 g/mol.
Where can I buy Iodoantipyrine I 131?
You can request a quote for Iodoantipyrine I 131 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iodoantipyrine I 131?
Yes, KEHONG BIO provides custom synthesis services for Iodoantipyrine I 131 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.