3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine
TL;DR: 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine (CAS 7469-38-7) is a chemical compound with molecular formula C23H21I2NO7S2 and molecular weight 740.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzylsulfonylamino)-3-(4-benzylsulfonyloxy-3,5-diiodophenyl)propanoic acid
Also Known As: 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine, 2-(benzylsulfonylamino)-3-(4-benzylsulfonyloxy-3,5-diiodophe, 2-(benzylsulfonylamino)-3-(4-benzylsulfonyloxy-3,5-diiodophenyl)propanoic acid
| Molecular Formula | C23H21I2NO7S2 |
|---|---|
| Molecular Weight | 740.88 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 740.8849 |
| Heavy Atoms | 35 |
| Complexity | 880.0 |
Chemical Identifiers
| CAS Number | 7469-38-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CS(=O)(=O)NC(CC2=CC(=C(C(=C2)I)OS(=O)(=O)CC3=CC=CC=C3)I)C(=O)O |
| InChIKey | IEHANMXSGFIVDY-UHFFFAOYSA-N |
Product Overview
3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine (CAS 7469-38-7), with molecular formula C23H21I2NO7S2 and molecular weight 740.88 g/mol. IUPAC: 2-(benzylsulfonylamino)-3-(4-benzylsulfonyloxy-3,5-diiodophenyl)propanoic acid.
Chemical Property Profile of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine
Property Insights of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine
The XLogP value of 4.7 indicates that 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine?
The CAS number of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine is 7469-38-7.
What is the molecular formula of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine?
The molecular formula of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine is C23H21I2NO7S2.
What is the molecular weight of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine?
The molecular weight of 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine is 740.88 g/mol.
Where can I buy 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine?
You can request a quote for 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Diiodo-N,O-bis(phenylmethanesulfonyl)tyrosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.