RefChem:230711
TL;DR: RefChem:230711 (CAS 71803-05-9) is a chemical compound with molecular formula C27H31ClN4O4S and molecular weight 542.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-carbamoylacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride
Also Known As: 1-Hexanesulfonanilide, 4'-(4-carbamoyl-9-acridinylamino)-3'-methoxy-, hydrochloride, 4'-(4-Carbamoyl-9-acridinylamino)-3'-methoxy-1-hexanesulfonanilide hydrochloride, 4-Acridinecarboxamide, 9-(4-(hexylsulfonamido)-2-methoxyanilino)-, monohydrochloride, (1-carbamoylacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride, RefChem:230711
| Molecular Formula | C27H31ClN4O4S |
|---|---|
| Molecular Weight | 542.18 g/mol |
| LogP | 1.35 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 542.1755 |
| Heavy Atoms | 37 |
| Complexity | 819.0 |
Chemical Identifiers
| CAS Number | 71803-05-9 |
|---|---|
| SMILES | CCCCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C(=NC4=CC=CC=C42)C=CC=C3C(=O)N)OC.[Cl-] |
| InChIKey | LQBNHXYOJAUJPS-UHFFFAOYSA-N |
Product Overview
RefChem:230711 (CAS 71803-05-9), with molecular formula C27H31ClN4O4S and molecular weight 542.18 g/mol. IUPAC: (1-carbamoylacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride.
Chemical Property Profile of RefChem:230711
Property Insights of RefChem:230711
The XLogP value of 1.35 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:230711. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:230711. Following Lipinski's Rule of Five, RefChem:230711 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:230711?
The CAS number of RefChem:230711 is 71803-05-9.
What is the molecular formula of RefChem:230711?
The molecular formula of RefChem:230711 is C27H31ClN4O4S.
What is the molecular weight of RefChem:230711?
The molecular weight of RefChem:230711 is 542.18 g/mol.
Where can I buy RefChem:230711?
You can request a quote for RefChem:230711 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:230711?
Yes, KEHONG BIO provides custom synthesis services for RefChem:230711 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.