n-Allyl-2,3,5-triiodobenzamide
TL;DR: n-Allyl-2,3,5-triiodobenzamide (CAS 452965-91-2) is a chemical compound with molecular formula C10H8I3NO and molecular weight 538.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5-triiodo-N-prop-2-enylbenzamide
Also Known As: n-Allyl-2,3,5-triiodobenzamide, 2,3,5-triiodo-N-prop-2-enylbenzamide, 2,3,5-triiodo-N-prop-2-enyl-benzamide, N-(2-Propenyl)-2,3,5-triiodobenzamide, J1.284.088H
| Molecular Formula | C10H8I3NO |
|---|---|
| Molecular Weight | 538.77 g/mol |
| LogP | 3.4162 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 538.774 |
| Heavy Atoms | 15 |
| Complexity | 403.89914 |
Chemical Identifiers
| CAS Number | 452965-91-2 |
|---|---|
| SMILES | C=CCNC(=O)C1=C(C(=CC(=C1)I)I)I |
Product Overview
n-Allyl-2,3,5-triiodobenzamide (CAS 452965-91-2), with molecular formula C10H8I3NO and molecular weight 538.77 g/mol. IUPAC: 2,3,5-triiodo-N-prop-2-enylbenzamide.
Chemical Property Profile of n-Allyl-2,3,5-triiodobenzamide
Property Insights of n-Allyl-2,3,5-triiodobenzamide
The XLogP value of 3.4162 indicates that n-Allyl-2,3,5-triiodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, n-Allyl-2,3,5-triiodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Allyl-2,3,5-triiodobenzamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of n-Allyl-2,3,5-triiodobenzamide?
The CAS number of n-Allyl-2,3,5-triiodobenzamide is 452965-91-2.
What is the molecular formula of n-Allyl-2,3,5-triiodobenzamide?
The molecular formula of n-Allyl-2,3,5-triiodobenzamide is C10H8I3NO.
What is the molecular weight of n-Allyl-2,3,5-triiodobenzamide?
The molecular weight of n-Allyl-2,3,5-triiodobenzamide is 538.77 g/mol.
Where can I buy n-Allyl-2,3,5-triiodobenzamide?
You can request a quote for n-Allyl-2,3,5-triiodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Allyl-2,3,5-triiodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for n-Allyl-2,3,5-triiodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.