1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride
TL;DR: 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride (CAS 5438-85-7) is a chemical compound with molecular formula C10H9ClN2O and molecular weight 208.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-iminonaphthalen-1-one;hydrochloride
Also Known As: ANQI, 2-amino-4-imino-naphthalen-1-one, 1(4H)-Naphthalenone, monohydrochloride, 2-amino-4-iminonaphthalen-1-one hydrochloride, 2-Amino-1,4-naphthoquinone imine hydrochloride
| Molecular Formula | C10H9ClN2O |
|---|---|
| Molecular Weight | 208.04 g/mol |
| LogP | 1.51517 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.04034 |
| Heavy Atoms | 14 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 5438-85-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=N)C=C(C2=O)N.Cl |
| InChIKey | GBXFEIWAUUUQFE-UHFFFAOYSA-N |
Product Overview
1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride (CAS 5438-85-7), with molecular formula C10H9ClN2O and molecular weight 208.04 g/mol. IUPAC: 2-amino-4-iminonaphthalen-1-one;hydrochloride.
Chemical Property Profile of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride
Property Insights of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride
The XLogP value of 1.51517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride. Following Lipinski's Rule of Five, 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride has 3 hydrogen bond donor(s) and 3 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 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride?
The CAS number of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride is 5438-85-7.
What is the molecular formula of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride?
The molecular formula of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride is C10H9ClN2O.
What is the molecular weight of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride?
The molecular weight of 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride is 208.04 g/mol.
Where can I buy 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride?
You can request a quote for 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1(4H)-Naphthalenone, 2-amino-4-imino-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.