n-(Iodoacetyl)phenylalanine
TL;DR: n-(Iodoacetyl)phenylalanine (CAS 62733-99-7) is a chemical compound with molecular formula C11H12INO3 and molecular weight 332.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-iodoacetyl)amino]-3-phenylpropanoic acid
Also Known As: n-(iodoacetyl)phenylalanine, N-Jodacetyl-phenylalanin, 2-[ amino]-3-phenyl-propanoicacid, 2-[(2-iodoacetyl)amino]-3-phenylpropanoic acid, 2-(2-IODOACETAMIDO)-3-PHENYLPROPANOIC ACID
| Molecular Formula | C11H12INO3 |
|---|---|
| Molecular Weight | 332.99 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.98618 |
| Heavy Atoms | 16 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 62733-99-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CI |
| InChIKey | XTMUZQRZFDMMCK-UHFFFAOYSA-N |
Product Overview
n-(Iodoacetyl)phenylalanine (CAS 62733-99-7), with molecular formula C11H12INO3 and molecular weight 332.99 g/mol. IUPAC: 2-[(2-iodoacetyl)amino]-3-phenylpropanoic acid.
Chemical Property Profile of n-(Iodoacetyl)phenylalanine
Property Insights of n-(Iodoacetyl)phenylalanine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(Iodoacetyl)phenylalanine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(Iodoacetyl)phenylalanine. Following Lipinski's Rule of Five, n-(Iodoacetyl)phenylalanine has 2 hydrogen bond donor(s) and 3 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-(Iodoacetyl)phenylalanine?
The CAS number of n-(Iodoacetyl)phenylalanine is 62733-99-7.
What is the molecular formula of n-(Iodoacetyl)phenylalanine?
The molecular formula of n-(Iodoacetyl)phenylalanine is C11H12INO3.
What is the molecular weight of n-(Iodoacetyl)phenylalanine?
The molecular weight of n-(Iodoacetyl)phenylalanine is 332.99 g/mol.
Where can I buy n-(Iodoacetyl)phenylalanine?
You can request a quote for n-(Iodoacetyl)phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(Iodoacetyl)phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for n-(Iodoacetyl)phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.