RefChem:438802
TL;DR: RefChem:438802 (CAS 63133-94-8) is a chemical compound with molecular formula C25H22ClN5O4 and molecular weight 491.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethyl-3-methylanilino]ethyl]isoindole-1,3-dione
Also Known As: N-[2-[[4-[(2-CHLORO-4-NITROPHENYL)AZO]-M-TOLYL]ETHYLAMINO]ETHYL]PHTHALIMIDE, N-(2-((4-((2-Chloro-4-nitrophenyl)azo)-m-tolyl)ethylamino)ethyl)phthalimide, 1H-Isoindole-1,3(2H)-dione, 2-(2-((4-((2-chloro-4-nitrophenyl)azo)-3-methylphenyl)ethylamino)ethyl)-, 1H-Isoindole-1,3(2H)-dione, 2-(2-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)-3-methylphenyl)ethylamino)ethyl)-, 1H-Isoindole-1,3(2H)-dione, 2-[2-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]ethylamino]ethyl]-
| Molecular Formula | C25H22ClN5O4 |
|---|---|
| Molecular Weight | 491.14 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.13602 |
| Heavy Atoms | 35 |
| Complexity | 796.0 |
Chemical Identifiers
| CAS Number | 63133-94-8 |
|---|---|
| SMILES | CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C3=CC(=C(C=C3)N=NC4=C(C=C(C=C4)[N+](=O)[O-])Cl)C |
| InChIKey | IDFURFDINRJNOG-UHFFFAOYSA-N |
Product Overview
RefChem:438802 (CAS 63133-94-8), with molecular formula C25H22ClN5O4 and molecular weight 491.14 g/mol. IUPAC: 2-[2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethyl-3-methylanilino]ethyl]isoindole-1,3-dione.
Chemical Property Profile of RefChem:438802
Property Insights of RefChem:438802
The XLogP value of 5.7 indicates that RefChem:438802 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:438802. Following Lipinski's Rule of Five, RefChem:438802 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:438802?
The CAS number of RefChem:438802 is 63133-94-8.
What is the molecular formula of RefChem:438802?
The molecular formula of RefChem:438802 is C25H22ClN5O4.
What is the molecular weight of RefChem:438802?
The molecular weight of RefChem:438802 is 491.14 g/mol.
Where can I buy RefChem:438802?
You can request a quote for RefChem:438802 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:438802?
Yes, KEHONG BIO provides custom synthesis services for RefChem:438802 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.