4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride
TL;DR: 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride (CAS 75159-36-3) is a chemical compound with molecular formula C9H10Cl2N4O3 and molecular weight 292.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(aminomethyl)-6-nitroquinazolin-4-one;dihydrochloride
Also Known As: 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride, 3-(Aminomethyl)-6-nitro-4(3H)-quinazolinone dihydrochloride, 3-(aminomethyl)-6-nitroquinazolin-4-one dihydrochloride, 3-(Aminomethyl)-6-nitroquinazolin-4(3H)-one--hydrogen chloride (1/2), RefChem:284133
| Molecular Formula | C9H10Cl2N4O3 |
|---|---|
| Molecular Weight | 292.01 g/mol |
| LogP | 1.06 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 292.013 |
| Heavy Atoms | 18 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 75159-36-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)CN.Cl.Cl |
| InChIKey | AOUXSGCKWGAPJJ-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride (CAS 75159-36-3), with molecular formula C9H10Cl2N4O3 and molecular weight 292.01 g/mol. IUPAC: 3-(aminomethyl)-6-nitroquinazolin-4-one;dihydrochloride.
Chemical Property Profile of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride
Property Insights of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride
The XLogP value of 1.06 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride has 3 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 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride?
The CAS number of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride is 75159-36-3.
What is the molecular formula of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride?
The molecular formula of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride is C9H10Cl2N4O3.
What is the molecular weight of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride?
The molecular weight of 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride is 292.01 g/mol.
Where can I buy 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride?
You can request a quote for 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 3-(aminomethyl)-6-nitro-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.