4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine
TL;DR: 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine (CAS 352555-40-9) is a chemical compound with molecular formula C9H11ClN4O2 and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-methyl-5-nitro-6-pyrrolidin-1-ylpyrimidine
Also Known As: 4-chloro-2-methyl-5-nitro-6-pyrrolidin-1-ylpyrimidine, AH-262/37295003, 4-chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine, 4-chloro-5-nitro-2-methyl-6-(1-pyrrolidinyl)pyrimidine
| Molecular Formula | C9H11ClN4O2 |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 1.94682 |
| Topological Polar Surface Area | 72.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.05705 |
| Heavy Atoms | 16 |
| Complexity | 431.76233 |
Chemical Identifiers
| CAS Number | 352555-40-9 |
|---|---|
| SMILES | CC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])N2CCCC2 |
Product Overview
4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine (CAS 352555-40-9), with molecular formula C9H11ClN4O2 and molecular weight 242.06 g/mol. IUPAC: 4-chloro-2-methyl-5-nitro-6-pyrrolidin-1-ylpyrimidine.
Chemical Property Profile of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine
Property Insights of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine
The XLogP value of 1.94682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine. The TPSA of 72.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine. Following Lipinski's Rule of Five, 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine has 0 hydrogen bond donor(s) and 5 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 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine?
The CAS number of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine is 352555-40-9.
What is the molecular formula of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine?
The molecular formula of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine is C9H11ClN4O2.
What is the molecular weight of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine?
The molecular weight of 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine is 242.06 g/mol.
Where can I buy 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine?
You can request a quote for 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.