4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine
TL;DR: 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine (CAS 79134-18-2) is a chemical compound with molecular formula C10H8N4O2S and molecular weight 248.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-[(5-nitro-2-pyridinyl)sulfanyl]pyrimidine
Also Known As: 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine, BAS 07774930, 4-methyl-2-(5-nitropyridin-2-yl)sulfanylpyrimidine, 4-Methyl-2-(5-nitro-pyridin-2-ylsulfanyl)-pyrimidine, 4-METHYL-2-[(5-NITROPYRIDIN-2-YL)SULFANYL]PYRIMIDINE
| Molecular Formula | C10H8N4O2S |
|---|---|
| Molecular Weight | 248.04 g/mol |
| LogP | 2.23942 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.0368 |
| Heavy Atoms | 17 |
| Complexity | 544.2571 |
Chemical Identifiers
| CAS Number | 79134-18-2 |
|---|---|
| SMILES | CC1=NC(=NC=C1)SC2=NC=C(C=C2)[N+](=O)[O-] |
Product Overview
4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine (CAS 79134-18-2), with molecular formula C10H8N4O2S and molecular weight 248.04 g/mol. IUPAC: 4-methyl-2-[(5-nitro-2-pyridinyl)sulfanyl]pyrimidine.
Chemical Property Profile of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine
Property Insights of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine
The XLogP value of 2.23942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine. Following Lipinski's Rule of Five, 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine 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 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine?
The CAS number of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine is 79134-18-2.
What is the molecular formula of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine?
The molecular formula of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine is C10H8N4O2S.
What is the molecular weight of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine?
The molecular weight of 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine is 248.04 g/mol.
Where can I buy 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine?
You can request a quote for 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2-[(5-nitro-2-pyridinyl)thio]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.