True Blue氯化物
TL;DR: True Blue氯化物 (CAS 71431-30-6) is a chemical compound with molecular formula C20H18Cl2N4O2 and molecular weight 416.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
True Blue氯化物
2-[2-(5-carbamimidoyl-1-benzofuran-2-yl)ethenyl]-1-benzofuran-5-carboximidamide;dihydrochloride
Also Known As: True Blue Chloride, 2-[(E)-2-(5-carbamimidoyl-1-benzofuran-2-yl)ethenyl]-1-benzofuran-5-carboximidamide;dihydrochloride
| Molecular Formula | C20H18Cl2N4O2 |
|---|---|
| Molecular Weight | 416.08 g/mol |
| LogP | 4.76114 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.0807 |
| Heavy Atoms | 28 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 71431-30-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(=N)N)C=C(O2)C=CC3=CC4=C(O3)C=CC(=C4)C(=N)N.Cl.Cl |
| InChIKey | WFZFMHDDZRBTFH-UHFFFAOYSA-N |
Product Overview
True Blue氯化物 (CAS 71431-30-6), with molecular formula C20H18Cl2N4O2 and molecular weight 416.08 g/mol. IUPAC: 2-[2-(5-carbamimidoyl-1-benzofuran-2-yl)ethenyl]-1-benzofuran-5-carboximidamide;dihydrochloride.
Chemical Property Profile of True Blue氯化物
Property Insights of True Blue氯化物
The XLogP value of 4.76114 indicates that True Blue氯化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for True Blue氯化物. Following Lipinski's Rule of Five, True Blue氯化物 has 6 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of True Blue氯化物?
The CAS number of True Blue氯化物 is 71431-30-6.
What is the molecular formula of True Blue氯化物?
The molecular formula of True Blue氯化物 is C20H18Cl2N4O2.
What is the molecular weight of True Blue氯化物?
The molecular weight of True Blue氯化物 is 416.08 g/mol.
Where can I buy True Blue氯化物?
You can request a quote for True Blue氯化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for True Blue氯化物?
Yes, KEHONG BIO provides custom synthesis services for True Blue氯化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.