![6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione structure](/static/products/908/90841-91-1.png)
6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione
TL;DR: 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione (CAS 90841-91-1) is a chemical compound with molecular formula C10H8IN3O2 and molecular weight 328.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-iodoanilino)-1H-pyrimidine-2,4-dione
Also Known As: BAS 00450424, 6-(4-iodoanilino)-1H-pyrimidine-2,4-dione, 6-(4-iodoanilino)-2,4(1H,3H)-pyrimidinedione, 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione, AB00091154-01
| Molecular Formula | C10H8IN3O2 |
|---|---|
| Molecular Weight | 328.97 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.96613 |
| Heavy Atoms | 16 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 90841-91-1 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=CC(=O)NC(=O)N2)I |
| InChIKey | XEBYVYBLCMFKBU-UHFFFAOYSA-N |
Product Overview
6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione (CAS 90841-91-1), with molecular formula C10H8IN3O2 and molecular weight 328.97 g/mol. IUPAC: 6-(4-iodoanilino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione
Property Insights of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione. Following Lipinski's Rule of Five, 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione 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-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione?
The CAS number of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione is 90841-91-1.
What is the molecular formula of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione?
The molecular formula of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione is C10H8IN3O2.
What is the molecular weight of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione?
The molecular weight of 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione is 328.97 g/mol.
Where can I buy 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione?
You can request a quote for 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-iodophenyl)amino]-2,4(1H,3H)-pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.