3-iodo-N-(oxolan-2-ylmethyl)benzamide
TL;DR: 3-iodo-N-(oxolan-2-ylmethyl)benzamide (CAS 333441-64-8) is a chemical compound with molecular formula C12H14INO2 and molecular weight 331.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodo-N-(oxolan-2-ylmethyl)benzamide
Also Known As: 3-iodo-N-(oxolan-2-ylmethyl)benzamide, BAS 01935401, 3-iodo-N-(tetrahydrofuran-2-ylmethyl)benzamide, 3-iodo-N-(tetrahydro-2-furanylmethyl)benzamide, (3-iodophenyl)-N-(oxolan-2-ylmethyl)carboxamide
| Molecular Formula | C12H14INO2 |
|---|---|
| Molecular Weight | 331.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.00693 |
| Heavy Atoms | 16 |
| Complexity | 375.03644 |
Chemical Identifiers
| CAS Number | 333441-64-8 |
|---|---|
| SMILES | C1CC(OC1)CNC(=O)C2=CC(=CC=C2)I |
Product Overview
3-iodo-N-(oxolan-2-ylmethyl)benzamide (CAS 333441-64-8), with molecular formula C12H14INO2 and molecular weight 331.01 g/mol. IUPAC: 3-iodo-N-(oxolan-2-ylmethyl)benzamide.
Chemical Property Profile of 3-iodo-N-(oxolan-2-ylmethyl)benzamide
Property Insights of 3-iodo-N-(oxolan-2-ylmethyl)benzamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-iodo-N-(oxolan-2-ylmethyl)benzamide. With a topological polar surface area (TPSA) of 38.33 Ų, 3-iodo-N-(oxolan-2-ylmethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-iodo-N-(oxolan-2-ylmethyl)benzamide 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 3-iodo-N-(oxolan-2-ylmethyl)benzamide?
The CAS number of 3-iodo-N-(oxolan-2-ylmethyl)benzamide is 333441-64-8.
What is the molecular formula of 3-iodo-N-(oxolan-2-ylmethyl)benzamide?
The molecular formula of 3-iodo-N-(oxolan-2-ylmethyl)benzamide is C12H14INO2.
What is the molecular weight of 3-iodo-N-(oxolan-2-ylmethyl)benzamide?
The molecular weight of 3-iodo-N-(oxolan-2-ylmethyl)benzamide is 331.01 g/mol.
Where can I buy 3-iodo-N-(oxolan-2-ylmethyl)benzamide?
You can request a quote for 3-iodo-N-(oxolan-2-ylmethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-iodo-N-(oxolan-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-iodo-N-(oxolan-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.