5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione
TL;DR: 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione (CAS 338413-91-5) is a chemical compound with molecular formula C11H8ClN3O3 and molecular weight 265.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-1-(2-chloro-3-pyridinyl)pyrimidine-2,4-dione
Also Known As: 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione, acetylchloropyridinylpyrimidinedione, 5-Acetyl-1-(2-chloropyridin-3-yl)pyrimidine-2,4(1H,3H)-dione, 0699AE, 5-acetyl-1-(2-chloropyridin-3-yl)pyrimidine-2,4-dione
| Molecular Formula | C11H8ClN3O3 |
|---|---|
| Molecular Weight | 265.03 g/mol |
| LogP | 0.7768 |
| Topological Polar Surface Area | 84.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.02542 |
| Heavy Atoms | 18 |
| Complexity | 732.7987 |
Chemical Identifiers
| CAS Number | 338413-91-5 |
|---|---|
| SMILES | CC(=O)C1=CN(C(=O)NC1=O)C2=C(N=CC=C2)Cl |
Product Overview
5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione (CAS 338413-91-5), with molecular formula C11H8ClN3O3 and molecular weight 265.03 g/mol. IUPAC: 5-acetyl-1-(2-chloro-3-pyridinyl)pyrimidine-2,4-dione.
Chemical Property Profile of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione
Property Insights of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione
The XLogP value of 0.7768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione. The TPSA of 84.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione. Following Lipinski's Rule of Five, 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione has 1 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-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione?
The CAS number of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione is 338413-91-5.
What is the molecular formula of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione?
The molecular formula of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione is C11H8ClN3O3.
What is the molecular weight of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione?
The molecular weight of 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione is 265.03 g/mol.
Where can I buy 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione?
You can request a quote for 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-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 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-1-(2-Chloro-3-Pyridinyl)-2,4(1H,3H)-Pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.