RefChem:326947
TL;DR: RefChem:326947 (CAS 25901-39-7) is a chemical compound with molecular formula C28H28I6N4O10 and molecular weight 1341.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(acetamidomethyl)-5-[3-[2-[3-[3-(acetamidomethyl)-5-carboxy-2,4,6-triiodoanilino]-3-oxopropoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid
Also Known As: Benzoic acid, 3,3'-(ethylenebis(oxyethylenecarbonylimino))bis(5-(acetamidomethyl)-2,4,6-triiodo-, 3,3'-{Ethane-1,2-diylbis[oxy(1-oxopropane-3,1-diyl)azanediyl]}bis[5-(acetamidomethyl)-2,4,6-triiodobenzoic acid], 3-(acetamidomethyl)-5-[3-[2-[3-[3-(acetamidomethyl)-5-carboxy-2,4,6-triiodoanilino]-3-oxopropoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid, BRN 2800768, RefChem:326947
| Molecular Formula | C28H28I6N4O10 |
|---|---|
| Molecular Weight | 1341.61 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 17 |
| Exact Mass | 1341.6074 |
| Heavy Atoms | 48 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 25901-39-7 |
|---|---|
| SMILES | CC(=O)NCC1=C(C(=C(C(=C1I)NC(=O)CCOCCOCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)CNC(=O)C)I)I)C(=O)O)I |
| InChIKey | VAUQOMROEVVLQH-UHFFFAOYSA-N |
Product Overview
RefChem:326947 (CAS 25901-39-7), with molecular formula C28H28I6N4O10 and molecular weight 1341.61 g/mol. IUPAC: 3-(acetamidomethyl)-5-[3-[2-[3-[3-(acetamidomethyl)-5-carboxy-2,4,6-triiodoanilino]-3-oxopropoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid.
Chemical Property Profile of RefChem:326947
Property Insights of RefChem:326947
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:326947. The TPSA of 209.0 Ų indicates high polarity, suggesting RefChem:326947 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:326947 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:326947?
The CAS number of RefChem:326947 is 25901-39-7.
What is the molecular formula of RefChem:326947?
The molecular formula of RefChem:326947 is C28H28I6N4O10.
What is the molecular weight of RefChem:326947?
The molecular weight of RefChem:326947 is 1341.61 g/mol.
Where can I buy RefChem:326947?
You can request a quote for RefChem:326947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:326947?
Yes, KEHONG BIO provides custom synthesis services for RefChem:326947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.