2-iodo-N-propylbenzamide
TL;DR: 2-iodo-N-propylbenzamide (CAS 333349-52-3) is a chemical compound with molecular formula C10H12INO and molecular weight 289.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-iodo-N-propylbenzamide
Also Known As: 2-iodo-N-propylbenzamide, 2-Iodo-n-propyl-benzamide, (2-iodophenyl)-N-propylcarboxamide, BAS 00784783
| Molecular Formula | C10H12INO |
|---|---|
| Molecular Weight | 289.00 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.99637 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 333349-52-3 |
|---|---|
| SMILES | CCCNC(=O)C1=CC=CC=C1I |
| InChIKey | LKHDFYFCROINHM-UHFFFAOYSA-N |
Product Overview
2-iodo-N-propylbenzamide (CAS 333349-52-3), with molecular formula C10H12INO and molecular weight 289.00 g/mol. IUPAC: 2-iodo-N-propylbenzamide.
Chemical Property Profile of 2-iodo-N-propylbenzamide
Property Insights of 2-iodo-N-propylbenzamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-iodo-N-propylbenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, 2-iodo-N-propylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-iodo-N-propylbenzamide 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 2-iodo-N-propylbenzamide?
The CAS number of 2-iodo-N-propylbenzamide is 333349-52-3.
What is the molecular formula of 2-iodo-N-propylbenzamide?
The molecular formula of 2-iodo-N-propylbenzamide is C10H12INO.
What is the molecular weight of 2-iodo-N-propylbenzamide?
The molecular weight of 2-iodo-N-propylbenzamide is 289.00 g/mol.
Where can I buy 2-iodo-N-propylbenzamide?
You can request a quote for 2-iodo-N-propylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-iodo-N-propylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-iodo-N-propylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.