Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride
TL;DR: Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride (CAS 66147-40-8) is a chemical compound with molecular formula C27H29ClN2O2 and molecular weight 448.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acridin-9-yl-[4-(7-carboxyheptyl)phenyl]azanium chloride
Also Known As: 8-(p-(9-Acridinylamino)phenyl)octanoic acid, hydrochloride, OCTANOIC ACID, 8-(p-(9-ACRIDINYLAMINO)PHENYL)-, HYDROCHLORIDE, acridin-9-yl-[4-(8-hydroxy-8-oxooctyl)phenyl]azanium chloride, Benzeneoctanoic acid, 4-(9-acridinylamino)-, monohydrochloride, RefChem:366883
| Molecular Formula | C27H29ClN2O2 |
|---|---|
| Molecular Weight | 448.19 g/mol |
| LogP | 2.89 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 448.19174 |
| Heavy Atoms | 32 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 66147-40-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)[NH2+]C4=CC=C(C=C4)CCCCCCCC(=O)O.[Cl-] |
| InChIKey | MHMWTQCIZQYWLW-UHFFFAOYSA-N |
Product Overview
Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride (CAS 66147-40-8), with molecular formula C27H29ClN2O2 and molecular weight 448.19 g/mol. IUPAC: acridin-9-yl-[4-(7-carboxyheptyl)phenyl]azanium chloride.
Chemical Property Profile of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride
Property Insights of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride
The XLogP value of 2.89 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride. Following Lipinski's Rule of Five, Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride has 2 hydrogen bond donor(s) and 4 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 Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride?
The CAS number of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride is 66147-40-8.
What is the molecular formula of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride?
The molecular formula of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride is C27H29ClN2O2.
What is the molecular weight of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride?
The molecular weight of Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride is 448.19 g/mol.
Where can I buy Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride?
You can request a quote for Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Octanoic acid, 8-(p-(9-acridinylamino)phenyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.