![5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione structure](/static/products/1052/105290-13-9.webp)
5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione
TL;DR: 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione (CAS 105290-13-9) is a chemical compound with molecular formula C10H8ClN3O3 and molecular weight 253.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chloroanilino)-1,3-diazinane-2,4,6-trione
Also Known As: NCIOpen2_002444, 5-(4-chloroanilino)-1,3-diazinane-2,4,6-trione, 5-[(4-chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione
| Molecular Formula | C10H8ClN3O3 |
|---|---|
| Molecular Weight | 253.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.02542 |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 105290-13-9 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2C(=O)NC(=O)NC2=O)Cl |
| InChIKey | MBYXMIWRAJFZBT-UHFFFAOYSA-N |
Product Overview
5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione (CAS 105290-13-9), with molecular formula C10H8ClN3O3 and molecular weight 253.03 g/mol. IUPAC: 5-(4-chloroanilino)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione
Property Insights of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione. Following Lipinski's Rule of Five, 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione has 3 hydrogen bond donor(s) and 4 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-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione?
The CAS number of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione is 105290-13-9.
What is the molecular formula of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione?
The molecular formula of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione is C10H8ClN3O3.
What is the molecular weight of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione?
The molecular weight of 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione is 253.03 g/mol.
Where can I buy 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione?
You can request a quote for 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Chlorophenyl)amino]pyrimidine-2,4,6(1h,3h,5h)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.