![5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione structure](/static/products/3753/3753-41-1.webp)
5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione
TL;DR: 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione (CAS 3753-41-1) is a chemical compound with molecular formula C8H12ClN3O2 and molecular weight 217.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-chloroethyl(ethyl)amino]-1H-pyrimidine-2,4-dione
Also Known As: 2-Chlor-6-methoxybenzoesaeure, 5-[(2-chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione, 5-[2-chloroethyl(ethyl)amino]-1H-pyrimidine-2,4-dione, 5-((2-Chloroethyl)(ethyl)amino)pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C8H12ClN3O2 |
|---|---|
| Molecular Weight | 217.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.0618 |
| Heavy Atoms | 14 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 3753-41-1 |
|---|---|
| SMILES | CCN(CCCl)C1=CNC(=O)NC1=O |
| InChIKey | IPQCQXQPDZSRCR-UHFFFAOYSA-N |
Product Overview
5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione (CAS 3753-41-1), with molecular formula C8H12ClN3O2 and molecular weight 217.06 g/mol. IUPAC: 5-[2-chloroethyl(ethyl)amino]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione
Property Insights of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione. Following Lipinski's Rule of Five, 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione has 2 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 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione?
The CAS number of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione is 3753-41-1.
What is the molecular formula of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione?
The molecular formula of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione is C8H12ClN3O2.
What is the molecular weight of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione?
The molecular weight of 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione is 217.06 g/mol.
Where can I buy 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione?
You can request a quote for 5-[(2-Chloroethyl)(ethyl)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-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Chloroethyl)(ethyl)amino]pyrimidine-2,4(1h,3h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.