N-tert-butyl-3-iodo-4-methoxybenzamide
TL;DR: N-tert-butyl-3-iodo-4-methoxybenzamide (CAS 315675-56-0) is a chemical compound with molecular formula C12H16INO2 and molecular weight 333.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-3-iodo-4-methoxybenzamide
Also Known As: N-tert-butyl-3-iodo-4-methoxybenzamide, N-(tert-butyl)-3-iodo-4-methoxybenzamide, AN-329/14085117, N-(tert-butyl)(3-iodo-4-methoxyphenyl)carboxamide, F3146-4172
| Molecular Formula | C12H16INO2 |
|---|---|
| Molecular Weight | 333.02 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.02258 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 315675-56-0 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=CC(=C(C=C1)OC)I |
| InChIKey | DBKHKMZEMCUMNT-UHFFFAOYSA-N |
Product Overview
N-tert-butyl-3-iodo-4-methoxybenzamide (CAS 315675-56-0), with molecular formula C12H16INO2 and molecular weight 333.02 g/mol. IUPAC: N-tert-butyl-3-iodo-4-methoxybenzamide.
Chemical Property Profile of N-tert-butyl-3-iodo-4-methoxybenzamide
Property Insights of N-tert-butyl-3-iodo-4-methoxybenzamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-3-iodo-4-methoxybenzamide. With a topological polar surface area (TPSA) of 38.3 Ų, N-tert-butyl-3-iodo-4-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-3-iodo-4-methoxybenzamide has 1 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 N-tert-butyl-3-iodo-4-methoxybenzamide?
The CAS number of N-tert-butyl-3-iodo-4-methoxybenzamide is 315675-56-0.
What is the molecular formula of N-tert-butyl-3-iodo-4-methoxybenzamide?
The molecular formula of N-tert-butyl-3-iodo-4-methoxybenzamide is C12H16INO2.
What is the molecular weight of N-tert-butyl-3-iodo-4-methoxybenzamide?
The molecular weight of N-tert-butyl-3-iodo-4-methoxybenzamide is 333.02 g/mol.
Where can I buy N-tert-butyl-3-iodo-4-methoxybenzamide?
You can request a quote for N-tert-butyl-3-iodo-4-methoxybenzamide 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-3-iodo-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-3-iodo-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.