RefChem:230710
TL;DR: RefChem:230710 (CAS 71802-81-8) is a chemical compound with molecular formula C28H33ClN4O4S and molecular weight 556.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetamidoacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride
Also Known As: 1-Hexanesulfonanilide, 4'-(3-acetamido-9-acridinylamino)-3'-methoxy-, hydrochloride, dihydrate, 4'-(3-Acetamido-9-acridinylamino)-3'-methoxy-1-hexanesulfonanilide hydrochloride dihydrate, Acetamide, N-(9-(4-(hexylsulfonamido)-2-methoxyanilino)-3-acridinyl)-, monohydrochloride, (2-acetamidoacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride, RefChem:230710
| Molecular Formula | C28H33ClN4O4S |
|---|---|
| Molecular Weight | 556.19 g/mol |
| LogP | 2.21 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 556.1911 |
| Heavy Atoms | 38 |
| Complexity | 835.0 |
Chemical Identifiers
| CAS Number | 71802-81-8 |
|---|---|
| SMILES | CCCCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=C(C=CC3=NC4=CC=CC=C42)NC(=O)C)OC.[Cl-] |
| InChIKey | AUDNRBLQKDELFY-UHFFFAOYSA-N |
Product Overview
RefChem:230710 (CAS 71802-81-8), with molecular formula C28H33ClN4O4S and molecular weight 556.19 g/mol. IUPAC: (2-acetamidoacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride.
Chemical Property Profile of RefChem:230710
Property Insights of RefChem:230710
The XLogP value of 2.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:230710. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:230710. Following Lipinski's Rule of Five, RefChem:230710 has 3 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:230710?
The CAS number of RefChem:230710 is 71802-81-8.
What is the molecular formula of RefChem:230710?
The molecular formula of RefChem:230710 is C28H33ClN4O4S.
What is the molecular weight of RefChem:230710?
The molecular weight of RefChem:230710 is 556.19 g/mol.
Where can I buy RefChem:230710?
You can request a quote for RefChem:230710 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:230710?
Yes, KEHONG BIO provides custom synthesis services for RefChem:230710 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.