RefChem:551759
TL;DR: RefChem:551759 (CAS 58547-80-1) is a chemical compound with molecular formula C22H29Cl2N5O5S and molecular weight 545.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[bis(2-hydroxyethyl)amino]-2-[[2,5-dichloro-4-(diethylsulfamoyl)phenyl]diazenyl]phenyl]acetamide
Also Known As: Acetamide, N-[5-[bis(2-hydroxyethyl)amino]-2-[[2,5-dichloro-4-[(diethylamino)sulfonyl]phenyl]azo]phenyl]-, Acetamide, N-(5-(bis(2-hydroxyethyl)amino)-2-((2,5-dichloro-4-((diethylamino)sulfonyl)phenyl)azo)phenyl)-, Acetamide, N-(5-(bis(2-hydroxyethyl)amino)-2-(2-(2,5-dichloro-4-((diethylamino)sulfonyl)phenyl)diazenyl)phenyl)-, n-(5-[bis(2-hydroxyethyl)amino]-2-{(e)-[2,5-dichloro-4-(diethylsulfamoyl)phenyl]diazenyl}phenyl)acetamide, N-[5-[BIS-(2-HYDROXYETHYL)AMINO]-2-[[2,5-DICHLORO-4-[(DIETHYLAMINO)SULFONYL]PHENYL]AZO]PHENYL]ACETAMIDE
| Molecular Formula | C22H29Cl2N5O5S |
|---|---|
| Molecular Weight | 545.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 545.12665 |
| Heavy Atoms | 35 |
| Complexity | 790.0 |
Chemical Identifiers
| CAS Number | 58547-80-1 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=C(C=C(C(=C1)Cl)N=NC2=C(C=C(C=C2)N(CCO)CCO)NC(=O)C)Cl |
| InChIKey | KHRQFBKQASROHI-UHFFFAOYSA-N |
Product Overview
RefChem:551759 (CAS 58547-80-1), with molecular formula C22H29Cl2N5O5S and molecular weight 545.13 g/mol. IUPAC: N-[5-[bis(2-hydroxyethyl)amino]-2-[[2,5-dichloro-4-(diethylsulfamoyl)phenyl]diazenyl]phenyl]acetamide.
Chemical Property Profile of RefChem:551759
Property Insights of RefChem:551759
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:551759. The TPSA of 143.0 Ų indicates high polarity, suggesting RefChem:551759 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:551759 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:551759?
The CAS number of RefChem:551759 is 58547-80-1.
What is the molecular formula of RefChem:551759?
The molecular formula of RefChem:551759 is C22H29Cl2N5O5S.
What is the molecular weight of RefChem:551759?
The molecular weight of RefChem:551759 is 545.13 g/mol.
Where can I buy RefChem:551759?
You can request a quote for RefChem:551759 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:551759?
Yes, KEHONG BIO provides custom synthesis services for RefChem:551759 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.