4-Acetaminomethyl-benzolsulfofluorid
TL;DR: 4-Acetaminomethyl-benzolsulfofluorid (CAS 219703-07-8) is a chemical compound with molecular formula C12H16N6O and molecular weight 260.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(diethylamino)-2-(1H-1,2,4-triazol-5-yldiazenyl)phenol
Also Known As: 4-Acetaminomethyl-benzolsulfofluorid, 3-(diethylamino)-6-(1H-1,2,4-triazol-5-ylhydrazinylidene)cyclohexa-2,4-dien-1-one, Phenol, 5-(diethylamino)-2-(1H-1,2,4-triazol-3-ylazo)-, (6E)-3-(diethylamino)-6-(1H-1,2,4-triazol-5-ylhydrazinylidene)cyclohexa-2,4-dien-1-one, 3-(Diethylamino)-6-[2-(1H-1,2,4-triazol-5-yl)hydrazinylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C12H16N6O |
|---|---|
| Molecular Weight | 260.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.13855 |
| Heavy Atoms | 19 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 219703-07-8 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)N=NC2=NC=NN2)O |
| InChIKey | SJMIGTIGCFRHSP-UHFFFAOYSA-N |
Product Overview
4-Acetaminomethyl-benzolsulfofluorid (CAS 219703-07-8), with molecular formula C12H16N6O and molecular weight 260.14 g/mol. IUPAC: 5-(diethylamino)-2-(1H-1,2,4-triazol-5-yldiazenyl)phenol.
Chemical Property Profile of 4-Acetaminomethyl-benzolsulfofluorid
Property Insights of 4-Acetaminomethyl-benzolsulfofluorid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetaminomethyl-benzolsulfofluorid. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetaminomethyl-benzolsulfofluorid. Following Lipinski's Rule of Five, 4-Acetaminomethyl-benzolsulfofluorid has 2 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-Acetaminomethyl-benzolsulfofluorid?
The CAS number of 4-Acetaminomethyl-benzolsulfofluorid is 219703-07-8.
What is the molecular formula of 4-Acetaminomethyl-benzolsulfofluorid?
The molecular formula of 4-Acetaminomethyl-benzolsulfofluorid is C12H16N6O.
What is the molecular weight of 4-Acetaminomethyl-benzolsulfofluorid?
The molecular weight of 4-Acetaminomethyl-benzolsulfofluorid is 260.14 g/mol.
Where can I buy 4-Acetaminomethyl-benzolsulfofluorid?
You can request a quote for 4-Acetaminomethyl-benzolsulfofluorid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetaminomethyl-benzolsulfofluorid?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetaminomethyl-benzolsulfofluorid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.