4,7,10,13-四氮杂十六烷二腈
TL;DR: 4,7,10,13-四氮杂十六烷二腈 (CAS 67990-04-9) is a chemical compound with molecular formula C12H24N6 and molecular weight 252.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,10,13-四氮杂十六烷二腈
3-[2-[2-[2-(2-cyanoethylamino)ethylamino]ethylamino]ethylamino]propanenitrile
Also Known As: 4,7,10,13-Tetraazahexadecanedinitrile, 4,7,10,13-tetraazahexadecane-1,16-dinitrile, 3,3 -[Ethylenebis(iminoethyleneimino)]bispropanenitrile, 3-[2-[2-[2-(2-cyanoethylamino)ethylamino]ethylamino]ethylamino]propanenitrile, 268-027-2
| Molecular Formula | C12H24N6 |
|---|---|
| Molecular Weight | 252.21 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 252.20624 |
| Heavy Atoms | 18 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 67990-04-9 |
|---|---|
| SMILES | C(CNCCNCCNCCNCCC#N)C#N |
| InChIKey | LZRSZAAWHRMGRR-UHFFFAOYSA-N |
Product Overview
4,7,10,13-四氮杂十六烷二腈 (CAS 67990-04-9), with molecular formula C12H24N6 and molecular weight 252.21 g/mol. IUPAC: 3-[2-[2-[2-(2-cyanoethylamino)ethylamino]ethylamino]ethylamino]propanenitrile.
Chemical Property Profile of 4,7,10,13-四氮杂十六烷二腈
Property Insights of 4,7,10,13-四氮杂十六烷二腈
The XLogP value of -2.1 indicates that 4,7,10,13-四氮杂十六烷二腈 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,7,10,13-四氮杂十六烷二腈. Following Lipinski's Rule of Five, 4,7,10,13-四氮杂十六烷二腈 has 4 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 4,7,10,13-四氮杂十六烷二腈?
The CAS number of 4,7,10,13-四氮杂十六烷二腈 is 67990-04-9.
What is the molecular formula of 4,7,10,13-四氮杂十六烷二腈?
The molecular formula of 4,7,10,13-四氮杂十六烷二腈 is C12H24N6.
What is the molecular weight of 4,7,10,13-四氮杂十六烷二腈?
The molecular weight of 4,7,10,13-四氮杂十六烷二腈 is 252.21 g/mol.
Where can I buy 4,7,10,13-四氮杂十六烷二腈?
You can request a quote for 4,7,10,13-四氮杂十六烷二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7,10,13-四氮杂十六烷二腈?
Yes, KEHONG BIO provides custom synthesis services for 4,7,10,13-四氮杂十六烷二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.