RefChem:296961
TL;DR: RefChem:296961 (CAS 56935-85-4) is a chemical compound with molecular formula C15H24N6O4S and molecular weight 384.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]-N,N-diethylaniline;methyl sulfate
Also Known As: EINECS 260-454-2, 3-((4-(Diethylamino)phenyl)azo)-1,4-dimethyl-1H-1,2,4-triazolium methyl sulphate, 1H-1,2,4-Triazolium, 3-((4-(diethylamino)phenyl)azo)-1,4-dimethyl-, methyl sulfate, 3-[[4- phenyl]azo]-1,4-dimethyl-1H-1,2,4-triazoliummethylsulphate, 4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]-N,N-diethylaniline; methyl sulfate
| Molecular Formula | C15H24N6O4S |
|---|---|
| Molecular Weight | 384.16 g/mol |
| LogP | 1.5992 |
| Topological Polar Surface Area | 116.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.158 |
| Heavy Atoms | 26 |
| Complexity | 813.1622 |
Chemical Identifiers
| CAS Number | 56935-85-4 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)N=NC2=NN(C=[N+]2C)C.COS(=O)(=O)[O-] |
Product Overview
RefChem:296961 (CAS 56935-85-4), with molecular formula C15H24N6O4S and molecular weight 384.16 g/mol. IUPAC: 4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]-N,N-diethylaniline;methyl sulfate.
Chemical Property Profile of RefChem:296961
Property Insights of RefChem:296961
The XLogP value of 1.5992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:296961. The TPSA of 116.09 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:296961. Following Lipinski's Rule of Five, RefChem:296961 has 0 hydrogen bond donor(s) and 8 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 RefChem:296961?
The CAS number of RefChem:296961 is 56935-85-4.
What is the molecular formula of RefChem:296961?
The molecular formula of RefChem:296961 is C15H24N6O4S.
What is the molecular weight of RefChem:296961?
The molecular weight of RefChem:296961 is 384.16 g/mol.
Where can I buy RefChem:296961?
You can request a quote for RefChem:296961 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296961?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296961 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.