7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione
TL;DR: 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione (CAS 70631-15-1) is a chemical compound with molecular formula C8H6N4O4 and molecular weight 222.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-amino-6-nitro-1H-quinazoline-2,4-dione
Also Known As: 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione, 7-amino-6-nitro-1H-quinazoline-2,4-dione, 2,4(1H,3H)-Quinazolinedione, 7-amino-6-nitro-, 7-amino-6-nitro-1,2,3,4-tetrahydroquinazoline-2,4-dione, RefChem:310281
| Molecular Formula | C8H6N4O4 |
|---|---|
| Molecular Weight | 222.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.03891 |
| Heavy Atoms | 16 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 70631-15-1 |
|---|---|
| SMILES | C1=C2C(=CC(=C1[N+](=O)[O-])N)NC(=O)NC2=O |
| InChIKey | JZSAGEZYDMVIKN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione (CAS 70631-15-1), with molecular formula C8H6N4O4 and molecular weight 222.04 g/mol. IUPAC: 7-amino-6-nitro-1H-quinazoline-2,4-dione.
Chemical Property Profile of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione
Property Insights of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione 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 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione?
The CAS number of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione is 70631-15-1.
What is the molecular formula of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione?
The molecular formula of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione is C8H6N4O4.
What is the molecular weight of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione?
The molecular weight of 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione is 222.04 g/mol.
Where can I buy 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione?
You can request a quote for 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Amino-6-nitroquinazoline-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.