2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine
TL;DR: 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine (CAS 99988-26-8) is a chemical compound with molecular formula C11H15N5O2 and molecular weight 249.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine
Also Known As: 2,4-bis-azetidin-1-yl-6-methyl-5-nitro-pyrimidine, 2,4-bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine, 2,4-di(azetidin-1-yl)-6-methyl-5-nitropyrimidine
| Molecular Formula | C11H15N5O2 |
|---|---|
| Molecular Weight | 249.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.12257 |
| Heavy Atoms | 18 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 99988-26-8 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N2CCC2)N3CCC3)[N+](=O)[O-] |
| InChIKey | MIBRQLHLKXUZNR-UHFFFAOYSA-N |
Product Overview
2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine (CAS 99988-26-8), with molecular formula C11H15N5O2 and molecular weight 249.12 g/mol. IUPAC: 2,4-bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine.
Chemical Property Profile of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine
Property Insights of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine. Following Lipinski's Rule of Five, 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine has 0 hydrogen bond donor(s) and 6 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 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine?
The CAS number of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine is 99988-26-8.
What is the molecular formula of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine?
The molecular formula of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine is C11H15N5O2.
What is the molecular weight of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine?
The molecular weight of 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine is 249.12 g/mol.
Where can I buy 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine?
You can request a quote for 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Bis(azetidin-1-yl)-6-methyl-5-nitropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.