N-tert-butyl-2-iodobenzamide
TL;DR: N-tert-butyl-2-iodobenzamide (CAS 329003-19-2) is a chemical compound with molecular formula C11H14INO and molecular weight 303.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-iodobenzamide
Also Known As: N-tert-butyl-2-iodobenzamide, N-tert-butyl-2-iodo-benzamide, Benzamide, N-(1,1-dimethylethyl)-2-iodo-, N-(tert-butyl)(2-iodophenyl)carboxamide, J1.490.624J
| Molecular Formula | C11H14INO |
|---|---|
| Molecular Weight | 303.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.01202 |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 329003-19-2 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=CC=CC=C1I |
| InChIKey | UMHMUOUBXYRXCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-tert-butyl-2-iodobenzamide (CAS 329003-19-2), with molecular formula C11H14INO and molecular weight 303.01 g/mol. IUPAC: N-tert-butyl-2-iodobenzamide.
Chemical Property Profile of N-tert-butyl-2-iodobenzamide
Property Insights of N-tert-butyl-2-iodobenzamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-2-iodobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-tert-butyl-2-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-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-tert-butyl-2-iodobenzamide?
The CAS number of N-tert-butyl-2-iodobenzamide is 329003-19-2.
What is the molecular formula of N-tert-butyl-2-iodobenzamide?
The molecular formula of N-tert-butyl-2-iodobenzamide is C11H14INO.
What is the molecular weight of N-tert-butyl-2-iodobenzamide?
The molecular weight of N-tert-butyl-2-iodobenzamide is 303.01 g/mol.
Where can I buy N-tert-butyl-2-iodobenzamide?
You can request a quote for N-tert-butyl-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-tert-butyl-2-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-2-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.