Nitromethaqualone hydrochloride
TL;DR: Nitromethaqualone hydrochloride (CAS 3946-23-4) is a chemical compound with molecular formula C16H14ClN3O4 and molecular weight 347.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxy-4-nitrophenyl)-2-methylquinazolin-4-one;hydrochloride
Also Known As: Nitromethaqualone hydrochloride, 3-(2-Methoxy-4-nitrophenyl)-2-methylquinazolin-4-one, hydrochloride, 4(3H)-Quinazolinone, 3-(2-methoxy-4-nitrophenyl)-2-methyl-, monohydrochloride, 4(3H)-Quinazolinone, 3-(2-methoxy-4-nitrophenyl)-2-methyl-, hydrochloride (1:1), 3-(2-methoxy-4-nitrophenyl)-2-methylquinazolin-4(3h)-one hydrochloride(1:1)
| Molecular Formula | C16H14ClN3O4 |
|---|---|
| Molecular Weight | 347.07 g/mol |
| LogP | 3.03272 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.0673 |
| Heavy Atoms | 24 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 3946-23-4 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)[N+](=O)[O-])OC.Cl |
| InChIKey | SIAJXPPTHOCXGA-UHFFFAOYSA-N |
Product Overview
Nitromethaqualone hydrochloride (CAS 3946-23-4), with molecular formula C16H14ClN3O4 and molecular weight 347.07 g/mol. IUPAC: 3-(2-methoxy-4-nitrophenyl)-2-methylquinazolin-4-one;hydrochloride.
Chemical Property Profile of Nitromethaqualone hydrochloride
Property Insights of Nitromethaqualone hydrochloride
The XLogP value of 3.03272 indicates that Nitromethaqualone hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitromethaqualone hydrochloride. Following Lipinski's Rule of Five, Nitromethaqualone hydrochloride has 1 hydrogen bond donor(s) and 5 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 Nitromethaqualone hydrochloride?
The CAS number of Nitromethaqualone hydrochloride is 3946-23-4.
What is the molecular formula of Nitromethaqualone hydrochloride?
The molecular formula of Nitromethaqualone hydrochloride is C16H14ClN3O4.
What is the molecular weight of Nitromethaqualone hydrochloride?
The molecular weight of Nitromethaqualone hydrochloride is 347.07 g/mol.
Where can I buy Nitromethaqualone hydrochloride?
You can request a quote for Nitromethaqualone hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitromethaqualone hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Nitromethaqualone hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.