RefChem:326953
TL;DR: RefChem:326953 (CAS 25901-40-0) is a chemical compound with molecular formula C30H32I6N4O11 and molecular weight 1385.63 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(acetamidomethyl)-5-[3-[2-[2-[3-[3-(acetamidomethyl)-5-carboxy-2,4,6-triiodoanilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid
Also Known As: Benzoic acid, 3,3'-(oxybis(ethyleneoxyethylenecarbonylimino))bis(5-(acetamidomethyl)-2,4,6-triiodo-, 3,3'-{Oxybis[ethane-2,1-diyloxy(1-oxopropane-3,1-diyl)azanediyl]}bis[5-(acetamidomethyl)-2,4,6-triiodobenzoic acid], 3-(acetamidomethyl)-5-[3-[2-[2-[3-[3-(acetamidomethyl)-5-carboxy-2,4,6-triiodoanilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid, BRN 2800862, RefChem:326953
| Molecular Formula | C30H32I6N4O11 |
|---|---|
| Molecular Weight | 1385.63 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 219.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 20 |
| Exact Mass | 1385.6335 |
| Heavy Atoms | 51 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 25901-40-0 |
|---|---|
| SMILES | CC(=O)NCC1=C(C(=C(C(=C1I)NC(=O)CCOCCOCCOCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)CNC(=O)C)I)I)C(=O)O)I |
| InChIKey | YDVBPAKLORMETB-UHFFFAOYSA-N |
Product Overview
RefChem:326953 (CAS 25901-40-0), with molecular formula C30H32I6N4O11 and molecular weight 1385.63 g/mol. IUPAC: 3-(acetamidomethyl)-5-[3-[2-[2-[3-[3-(acetamidomethyl)-5-carboxy-2,4,6-triiodoanilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodobenzoic acid.
Chemical Property Profile of RefChem:326953
Property Insights of RefChem:326953
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:326953. The TPSA of 219.0 Ų indicates high polarity, suggesting RefChem:326953 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:326953 has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:326953?
The CAS number of RefChem:326953 is 25901-40-0.
What is the molecular formula of RefChem:326953?
The molecular formula of RefChem:326953 is C30H32I6N4O11.
What is the molecular weight of RefChem:326953?
The molecular weight of RefChem:326953 is 1385.63 g/mol.
Where can I buy RefChem:326953?
You can request a quote for RefChem:326953 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:326953?
Yes, KEHONG BIO provides custom synthesis services for RefChem:326953 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.