![5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione structure](/static/products/4248/42485-28-9.webp)
5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione
TL;DR: 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione (CAS 42485-28-9) is a chemical compound with molecular formula C11H8N4O4 and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-nitrophenyl)methylideneamino]-1H-pyrimidine-2,4-dione
Also Known As: 5-[(3-nitrophenyl)methylideneamino]-1H-pyrimidine-2,4-dione, 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C11H8N4O4 |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.05457 |
| Heavy Atoms | 19 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 42485-28-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C=NC2=CNC(=O)NC2=O |
| InChIKey | VMOGNQWRGSIQHU-UHFFFAOYSA-N |
Product Overview
5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione (CAS 42485-28-9), with molecular formula C11H8N4O4 and molecular weight 260.05 g/mol. IUPAC: 5-[(3-nitrophenyl)methylideneamino]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione
Property Insights of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione has 2 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 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione?
The CAS number of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione is 42485-28-9.
What is the molecular formula of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione is C11H8N4O4.
What is the molecular weight of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione is 260.05 g/mol.
Where can I buy 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 5-{(E)-[(3-Nitrophenyl)methylidene]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 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-{(E)-[(3-Nitrophenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.