Ipodate Calcium
TL;DR: Ipodate Calcium (CAS 1151-11-7) is a chemical compound with molecular formula C24H24CaI6N4O4 and molecular weight 1233.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(3-[3-(dimethylaminomethylideneamino)-2,4,6-triiodophenyl]propanoate)
Also Known As: IPODATE CALCIUM, Oragrafin Calcium, Calcium Ipodate, Iopodate calcium, Ipodate calcium salt
| Molecular Formula | C24H24CaI6N4O4 |
|---|---|
| Molecular Weight | 1233.57 g/mol |
| LogP | 4.43 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 1233.5692 |
| Heavy Atoms | 39 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 1151-11-7 |
|---|---|
| SMILES | CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)[O-])I)I.CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)[O-])I)I.[Ca+2] |
| InChIKey | HVZGHKKROPCBDE-UHFFFAOYSA-L |
Product Overview
Ipodate Calcium (CAS 1151-11-7), with molecular formula C24H24CaI6N4O4 and molecular weight 1233.57 g/mol. IUPAC: calcium bis(3-[3-(dimethylaminomethylideneamino)-2,4,6-triiodophenyl]propanoate).
Chemical Property Profile of Ipodate Calcium
Property Insights of Ipodate Calcium
The XLogP value of 4.43 indicates that Ipodate Calcium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ipodate Calcium. Following Lipinski's Rule of Five, Ipodate Calcium has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ipodate Calcium?
The CAS number of Ipodate Calcium is 1151-11-7.
What is the molecular formula of Ipodate Calcium?
The molecular formula of Ipodate Calcium is C24H24CaI6N4O4.
What is the molecular weight of Ipodate Calcium?
The molecular weight of Ipodate Calcium is 1233.57 g/mol.
Where can I buy Ipodate Calcium?
You can request a quote for Ipodate Calcium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ipodate Calcium?
Yes, KEHONG BIO provides custom synthesis services for Ipodate Calcium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.