Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride
TL;DR: Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride (CAS 64894-87-7) is a chemical compound with molecular formula C21H17ClN2O3 and molecular weight 380.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(acridin-9-ylamino)-3-methoxybenzoic acid;hydrochloride
Also Known As: Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride, 4-(9-Acridinylamino)-3-methoxybenzoic acid monohydrochloride, 4-(acridin-9-ylamino)-3-methoxybenzoic acid hydrochloride, 4-[(Acridin-9-yl)amino]-3-methoxybenzoic acid--hydrogen chloride (1/1)
| Molecular Formula | C21H17ClN2O3 |
|---|---|
| Molecular Weight | 380.09 g/mol |
| LogP | 5.2602 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.09277 |
| Heavy Atoms | 27 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 64894-87-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=O)O)NC2=C3C=CC=CC3=NC4=CC=CC=C42.Cl |
| InChIKey | LXNMTKSVJXVGKR-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride (CAS 64894-87-7), with molecular formula C21H17ClN2O3 and molecular weight 380.09 g/mol. IUPAC: 4-(acridin-9-ylamino)-3-methoxybenzoic acid;hydrochloride.
Chemical Property Profile of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride
Property Insights of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride
The XLogP value of 5.2602 indicates that Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride. Following Lipinski's Rule of Five, Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride?
The CAS number of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride is 64894-87-7.
What is the molecular formula of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride?
The molecular formula of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride is C21H17ClN2O3.
What is the molecular weight of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride?
The molecular weight of Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride is 380.09 g/mol.
Where can I buy Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride?
You can request a quote for Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-(9-acridinylamino)-3-methoxy-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.