CID 21023
TL;DR: CID 21023 (CAS 4914-65-2) is a chemical compound with molecular formula C25H27I6N3O12 and molecular weight 1322.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-[2-(3-carboxy-2,4,6-triiodoanilino)-2-oxoethoxy]acetyl]amino]-2,4,6-triiodobenzoic acid;6-(methylamino)hexane-1,2,3,4,5-pentol
Also Known As: MEGLUMINE IOGLYCAMIDE, 3,3'-{Oxybis[(1-oxoethane-2,1-diyl)azanediyl]}bis(2,4,6-triiodobenzoic acid)--1-deoxy-1-(methylamino)hexitol (1/1), 3-[[2-[2-(3-carboxy-2,4,6-triiodoanilino)-2-oxoethoxy]acetyl]amino]-2,4,6-triiodobenzoic acid; 6-(methylamino)hexane-1,2,3,4,5-pentol, 3-[[2-[2-(3-Carboxy-2,4,6-triiodoanilino)-2-oxoethoxy]acetyl]amino]-2,4,6-triiodobenzoic acid;6-(methylamino)hexane-1,2,3,4,5-pentol
| Molecular Formula | C25H27I6N3O12 |
|---|---|
| Molecular Weight | 1322.59 g/mol |
| LogP | 1.95 |
| Topological Polar Surface Area | 255.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 14 |
| Exact Mass | 1322.5863 |
| Heavy Atoms | 46 |
| Complexity | 836.0 |
Chemical Identifiers
| CAS Number | 4914-65-2 |
|---|---|
| SMILES | CNCC(C(C(C(CO)O)O)O)O.C1=C(C(=C(C(=C1I)NC(=O)COCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I |
| InChIKey | FRMWIRNTYJSUHV-UHFFFAOYSA-N |
Product Overview
CID 21023 (CAS 4914-65-2), with molecular formula C25H27I6N3O12 and molecular weight 1322.59 g/mol. IUPAC: 3-[[2-[2-(3-carboxy-2,4,6-triiodoanilino)-2-oxoethoxy]acetyl]amino]-2,4,6-triiodobenzoic acid;6-(methylamino)hexane-1,2,3,4,5-pentol.
Chemical Property Profile of CID 21023
Property Insights of CID 21023
The XLogP value of 1.95 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CID 21023. The TPSA of 255.0 Ų indicates high polarity, suggesting CID 21023 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CID 21023 has 10 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CID 21023?
The CAS number of CID 21023 is 4914-65-2.
What is the molecular formula of CID 21023?
The molecular formula of CID 21023 is C25H27I6N3O12.
What is the molecular weight of CID 21023?
The molecular weight of CID 21023 is 1322.59 g/mol.
Where can I buy CID 21023?
You can request a quote for CID 21023 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 21023?
Yes, KEHONG BIO provides custom synthesis services for CID 21023 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.