RefChem:868753
TL;DR: RefChem:868753 (CAS 68134-39-4) is a chemical compound with molecular formula C18H17IN6O3 and molecular weight 492.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-cyano-6-iodo-4-nitrophenyl)diazenyl]-5-(dimethylamino)phenyl]propanamide
Also Known As: n-[2-[azo]-5- phenyl]propionamide, N-[2-[ azo]-5- phenyl]propionamide, Propanamide, N-[2-[(2-cyano-6-iodo-4-nitrophenyl)azo]-5-(dimethylamino)phenyl]-, 3-Propionylamino-4-(2-cyano-6-iodo-4-nitrophenylazo)-N,N-dimethylaniline, Propanamide, N-(2-((2-cyano-6-iodo-4-nitrophenyl)azo)-5-(dimethylamino)phenyl)-
| Molecular Formula | C18H17IN6O3 |
|---|---|
| Molecular Weight | 492.04 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 492.04068 |
| Heavy Atoms | 28 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 68134-39-4 |
|---|---|
| SMILES | CCC(=O)NC1=C(C=CC(=C1)N(C)C)N=NC2=C(C=C(C=C2I)[N+](=O)[O-])C#N |
| InChIKey | WPPWYKPFBBRQQI-UHFFFAOYSA-N |
Product Overview
RefChem:868753 (CAS 68134-39-4), with molecular formula C18H17IN6O3 and molecular weight 492.04 g/mol. IUPAC: N-[2-[(2-cyano-6-iodo-4-nitrophenyl)diazenyl]-5-(dimethylamino)phenyl]propanamide.
Chemical Property Profile of RefChem:868753
Property Insights of RefChem:868753
The XLogP value of 3.7 indicates that RefChem:868753 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:868753. Following Lipinski's Rule of Five, RefChem:868753 has 1 hydrogen bond donor(s) and 7 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:868753?
The CAS number of RefChem:868753 is 68134-39-4.
What is the molecular formula of RefChem:868753?
The molecular formula of RefChem:868753 is C18H17IN6O3.
What is the molecular weight of RefChem:868753?
The molecular weight of RefChem:868753 is 492.04 g/mol.
Where can I buy RefChem:868753?
You can request a quote for RefChem:868753 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:868753?
Yes, KEHONG BIO provides custom synthesis services for RefChem:868753 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.