DHDE
TL;DR: DHDE (CAS 95134-61-5) is a chemical compound with molecular formula C22H24N2O10 and molecular weight 476.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[2-[[(S)-carboxy-(2-hydroxyphenyl)methyl]-(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-(2-hydroxyphenyl)acetic acid
Also Known As: DHDE, N,N'-Bis(hydroxycarbonylmethyl)-N,N'-bis(alpha-hydroxycarbonyl-2-hydroxytolyl)diaminoethane, Glycine, N,N'-ethylenebis(N-(carboxymethyl)-2-(o-hydroxyphenyl)-, (2S)-2-[carboxymethyl-[2-[carboxymethyl-[(1S)-2-hydroxy-1-(2-hydroxyphenyl)-2-oxoethyl]amino]ethyl]amino]-2-(2-hydroxyphenyl)acetic acid, (2S,2'S)-2,2'-{Ethane-1,2-diylbis[(carboxymethyl)azanediyl]}bis[(2-hydroxyphenyl)acetic acid]
| Molecular Formula | C22H24N2O10 |
|---|---|
| Molecular Weight | 476.14 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 476.1431 |
| Heavy Atoms | 34 |
| Complexity | 672.0 |
Chemical Identifiers
| CAS Number | 95134-61-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[C@@H](C(=O)O)N(CCN(CC(=O)O)[C@@H](C2=CC=CC=C2O)C(=O)O)CC(=O)O)O |
| InChIKey | OKTLIOWWGVGPKG-PMACEKPBSA-N |
Product Overview
DHDE (CAS 95134-61-5), with molecular formula C22H24N2O10 and molecular weight 476.14 g/mol. IUPAC: (2S)-2-[2-[[(S)-carboxy-(2-hydroxyphenyl)methyl]-(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-(2-hydroxyphenyl)acetic acid.
Chemical Property Profile of DHDE
Property Insights of DHDE
The XLogP value of -3.2 indicates that DHDE is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 196.0 Ų indicates high polarity, suggesting DHDE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DHDE has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DHDE?
The CAS number of DHDE is 95134-61-5.
What is the molecular formula of DHDE?
The molecular formula of DHDE is C22H24N2O10.
What is the molecular weight of DHDE?
The molecular weight of DHDE is 476.14 g/mol.
Where can I buy DHDE?
You can request a quote for DHDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DHDE?
Yes, KEHONG BIO provides custom synthesis services for DHDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.