![6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione structure](/static/products/7934/79344-67-5.webp)
6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione
TL;DR: 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione (CAS 79344-67-5) is a chemical compound with molecular formula C10H8N4O4 and molecular weight 248.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-nitroanilino)-1H-pyrimidine-2,4-dione
Also Known As: 6-(4-nitroanilino)-1H-pyrimidine-2,4-dione, BAS 00450427, 6-(4-Nitroanilino)pyrimidine-2,4(1H,3H)-dione, 6-(4-nitrophenylamino)-1H-pyrimidine-2,4-dione, 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C10H8N4O4 |
|---|---|
| Molecular Weight | 248.05 g/mol |
| LogP | 0.715 |
| Topological Polar Surface Area | 120.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.05455 |
| Heavy Atoms | 18 |
| Complexity | 657.76416 |
Chemical Identifiers
| CAS Number | 79344-67-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=CC(=O)NC(=O)N2)[N+](=O)[O-] |
Product Overview
6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione (CAS 79344-67-5), with molecular formula C10H8N4O4 and molecular weight 248.05 g/mol. IUPAC: 6-(4-nitroanilino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione
Property Insights of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.715 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione. The TPSA of 120.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 6-[(4-nitrophenyl)amino]pyrimidine-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 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione?
The CAS number of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione is 79344-67-5.
What is the molecular formula of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione is C10H8N4O4.
What is the molecular weight of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione is 248.05 g/mol.
Where can I buy 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 6-[(4-nitrophenyl)amino]pyrimidine-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 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-nitrophenyl)amino]pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.