6-(4-phenylanilino)-1H-pyrimidine-2,4-dione
TL;DR: 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione (CAS 21333-11-9) is a chemical compound with molecular formula C16H13N3O2 and molecular weight 279.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-phenylanilino)-1H-pyrimidine-2,4-dione
Also Known As: 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione, 6-[([1,1'-Biphenyl]-4-yl)amino]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C16H13N3O2 |
|---|---|
| Molecular Weight | 279.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.10077 |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 21333-11-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)NC3=CC(=O)NC(=O)N3 |
| InChIKey | ALICJNITDVBBJC-UHFFFAOYSA-N |
Product Overview
6-(4-phenylanilino)-1H-pyrimidine-2,4-dione (CAS 21333-11-9), with molecular formula C16H13N3O2 and molecular weight 279.10 g/mol. IUPAC: 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione
Property Insights of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione has 3 hydrogen bond donor(s) and 3 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-phenylanilino)-1H-pyrimidine-2,4-dione?
The CAS number of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione is 21333-11-9.
What is the molecular formula of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione?
The molecular formula of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione is C16H13N3O2.
What is the molecular weight of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione?
The molecular weight of 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione is 279.10 g/mol.
Where can I buy 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione?
You can request a quote for 6-(4-phenylanilino)-1H-pyrimidine-2,4-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-phenylanilino)-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-phenylanilino)-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.