Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate
TL;DR: Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate (CAS 73622-61-4) is a chemical compound with molecular formula C46H42N4O5 and molecular weight 730.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-[4-[(4-ethylacridin-9-yl)amino]phenyl]acetic acid);hydrate
Also Known As: C23H20N2O2.1/2H2O, Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate, p-(9-(4-Ethylacridinyl)amino)phenylacetic acid, hemihydrate, C23-H20-N2-O2.1/2H2-O, 2-[4-[(4-ethylacridin-9-yl)amino]phenyl]acetic acid hydrate
| Molecular Formula | C46H42N4O5 |
|---|---|
| Molecular Weight | 730.32 g/mol |
| LogP | 9.8175 |
| Topological Polar Surface Area | 155.94 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 730.3155 |
| Heavy Atoms | 55 |
| Complexity | 2456.8188 |
Chemical Identifiers
| CAS Number | 73622-61-4 |
|---|---|
| SMILES | CCC1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=CC=C(C=C4)CC(=O)O.CCC1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=CC=C(C=C4)CC(=O)O.O |
Product Overview
Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate (CAS 73622-61-4), with molecular formula C46H42N4O5 and molecular weight 730.32 g/mol. IUPAC: bis(2-[4-[(4-ethylacridin-9-yl)amino]phenyl]acetic acid);hydrate.
Chemical Property Profile of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate
Property Insights of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate
The XLogP value of 9.8175 indicates that Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.94 Ų indicates high polarity, suggesting Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate?
The CAS number of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate is 73622-61-4.
What is the molecular formula of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate?
The molecular formula of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate is C46H42N4O5.
What is the molecular weight of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate?
The molecular weight of Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate is 730.32 g/mol.
Where can I buy Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate?
You can request a quote for Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, p-(4-ethyl-9-acridinylamino)phenyl-, hemihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.