双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐
TL;DR: 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 (CAS 17162-25-3) is a chemical compound with molecular formula C16H23I2N3O9 and molecular weight 654.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐
bis[bis(2-hydroxyethyl)amino] 3,5-diiodo-1-methyl-4-oxopyridine-2,6-dicarboxylate
Also Known As: BIS(DIETHANOLAMINE)-N-METHYL-3,5-DIIODOCHELIDAMATE, Bis-diethanolamine-N-methyl-3,5-diiodo chelidamate, 2,6-Pyridinedicarboxylic acid, 1,4-dihydro-3,5-diiodo-1-methyl-4-oxo-, 2,6-bis(bis(2-hydroxyethyl)azanyl) ester, 2,6-Bis({[bis(2-hydroxyethyl)amino]oxy}carbonyl)-3,5-diiodo-1-methylpyridin-4(1H)-one, BIS(BIS(2-HYDROXYETHYL)AMINO) 3,5-DIIODO-1-METHYL-4-OXO-PYRIDINE-2,6-DICARBOXYLATE
| Molecular Formula | C16H23I2N3O9 |
|---|---|
| Molecular Weight | 654.95 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 14 |
| Exact Mass | 654.9524 |
| Heavy Atoms | 30 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 17162-25-3 |
|---|---|
| SMILES | CN1C(=C(C(=O)C(=C1C(=O)ON(CCO)CCO)I)I)C(=O)ON(CCO)CCO |
| InChIKey | DGHCQLCYKHSSGN-UHFFFAOYSA-N |
Product Overview
双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 (CAS 17162-25-3), with molecular formula C16H23I2N3O9 and molecular weight 654.95 g/mol. IUPAC: bis[bis(2-hydroxyethyl)amino] 3,5-diiodo-1-methyl-4-oxopyridine-2,6-dicarboxylate.
Chemical Property Profile of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐
Property Insights of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐
The XLogP value of -0.6 indicates that 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 has 4 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 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐?
The CAS number of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 is 17162-25-3.
What is the molecular formula of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐?
The molecular formula of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 is C16H23I2N3O9.
What is the molecular weight of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐?
The molecular weight of 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 is 654.95 g/mol.
Where can I buy 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐?
You can request a quote for 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐?
Yes, KEHONG BIO provides custom synthesis services for 双(二乙醇胺)-N-甲基-3,5-二碘白屈氨酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.