5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride
TL;DR: 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride (CAS 64895-17-6) is a chemical compound with molecular formula C20H15ClN2O2 and molecular weight 350.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(acridin-9-ylamino)-2-hydroxycyclohepta-2,4,6-trien-1-one;hydrochloride
Also Known As: 5'-(9-Acridinylaminotropolone hydrochloride, 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride, 2,4,6-Cycloheptatrien-1-one, 5-(9-acridinylamino)-2-hydroxy-, monohydrochloride, 5-(acridin-9-ylamino)-2-hydroxycyclohepta-2,4,6-trien-1-one hydrochloride, 5-[(Acridin-9(10H)-ylidene)amino]-2-hydroxycyclohepta-2,4,6-trien-1-one--hydrogen chloride (1/1)
| Molecular Formula | C20H15ClN2O2 |
|---|---|
| Molecular Weight | 350.08 g/mol |
| LogP | 4.6192 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.0822 |
| Heavy Atoms | 25 |
| Complexity | 570.0 |
Chemical Identifiers
| CAS Number | 64895-17-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C(=O)C=C4)O.Cl |
| InChIKey | KPPSQUJJFJVABP-UHFFFAOYSA-N |
Product Overview
5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride (CAS 64895-17-6), with molecular formula C20H15ClN2O2 and molecular weight 350.08 g/mol. IUPAC: 5-(acridin-9-ylamino)-2-hydroxycyclohepta-2,4,6-trien-1-one;hydrochloride.
Chemical Property Profile of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride
Property Insights of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride
The XLogP value of 4.6192 indicates that 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride. Following Lipinski's Rule of Five, 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride has 3 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 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride?
The CAS number of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride is 64895-17-6.
What is the molecular formula of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride?
The molecular formula of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride is C20H15ClN2O2.
What is the molecular weight of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride?
The molecular weight of 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride is 350.08 g/mol.
Where can I buy 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride?
You can request a quote for 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-(9-Acridinylamino)-2-hydroxy-2,4,6-cycloheptatrien-1-one monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.