Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)
TL;DR: Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) (CAS 62669-69-6) is a chemical compound with molecular formula C21H27ClN2O5 and molecular weight 422.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(diethylamino)xanthen-3-ylidene]-diethylazanium perchlorate
Also Known As: Cid 65216, Xanthylium, 3,6-bis(diethylamino)-, perchlorate, Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1), 3,6-Bis(diethylamino)xanthen-10-ium perchlorate, [6-(diethylamino)xanthen-3-ylidene]-diethylazanium perchlorate
| Molecular Formula | C21H27ClN2O5 |
|---|---|
| Molecular Weight | 422.16 g/mol |
| LogP | -0.56 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.16086 |
| Heavy Atoms | 29 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 62669-69-6 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C3C=CC(=[N+](CC)CC)C=C3O2.[O-]Cl(=O)(=O)=O |
| InChIKey | UYOSCERBTRLUNZ-UHFFFAOYSA-M |
Product Overview
Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) (CAS 62669-69-6), with molecular formula C21H27ClN2O5 and molecular weight 422.16 g/mol. IUPAC: [6-(diethylamino)xanthen-3-ylidene]-diethylazanium perchlorate.
Chemical Property Profile of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)
Property Insights of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)
The XLogP value of -0.56 indicates that Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1). Following Lipinski's Rule of Five, Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)?
The CAS number of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) is 62669-69-6.
What is the molecular formula of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)?
The molecular formula of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) is C21H27ClN2O5.
What is the molecular weight of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)?
The molecular weight of Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) is 422.16 g/mol.
Where can I buy Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)?
You can request a quote for Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.