N-hexyl-2-iodobenzamide
TL;DR: N-hexyl-2-iodobenzamide (CAS 79271-29-7) is a chemical compound with molecular formula C13H18INO and molecular weight 331.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-hexyl-2-iodobenzamide
Also Known As: N-hexyl-2-iodobenzamide, N-Hexyl-2-iodo-benzamide, N-hexyl-o-iodobenzamide, starbld0036200, N-hexyl(2-iodophenyl)carboxamide
| Molecular Formula | C13H18INO |
|---|---|
| Molecular Weight | 331.04 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.0433 |
| Heavy Atoms | 16 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 79271-29-7 |
|---|---|
| SMILES | CCCCCCNC(=O)C1=CC=CC=C1I |
| InChIKey | QOMHWKKJSDWZHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-hexyl-2-iodobenzamide (CAS 79271-29-7), with molecular formula C13H18INO and molecular weight 331.04 g/mol. IUPAC: N-hexyl-2-iodobenzamide.
Chemical Property Profile of N-hexyl-2-iodobenzamide
Property Insights of N-hexyl-2-iodobenzamide
The XLogP value of 3.6 indicates that N-hexyl-2-iodobenzamide 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-hexyl-2-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-hexyl-2-iodobenzamide has 1 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 N-hexyl-2-iodobenzamide?
The CAS number of N-hexyl-2-iodobenzamide is 79271-29-7.
What is the molecular formula of N-hexyl-2-iodobenzamide?
The molecular formula of N-hexyl-2-iodobenzamide is C13H18INO.
What is the molecular weight of N-hexyl-2-iodobenzamide?
The molecular weight of N-hexyl-2-iodobenzamide is 331.04 g/mol.
Where can I buy N-hexyl-2-iodobenzamide?
You can request a quote for N-hexyl-2-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-hexyl-2-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-hexyl-2-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.