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2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine
TL;DR: 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine (CAS 338420-95-4) is a chemical compound with molecular formula C17H12N4O2S and molecular weight 336.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-nitro-2-pyridinyl)sulfanyl]-4-(2-phenylethenyl)pyrimidine
Also Known As: 2-[(3-nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine, 2-(3-nitropyridin-2-yl)sulfanyl-4-(2-phenylethenyl)pyrimidine
| Molecular Formula | C17H12N4O2S |
|---|---|
| Molecular Weight | 336.07 g/mol |
| LogP | 4.1014 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.06808 |
| Heavy Atoms | 24 |
| Complexity | 884.52374 |
Chemical Identifiers
| CAS Number | 338420-95-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC2=NC(=NC=C2)SC3=C(C=CC=N3)[N+](=O)[O-] |
Product Overview
2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine (CAS 338420-95-4), with molecular formula C17H12N4O2S and molecular weight 336.07 g/mol. IUPAC: 2-[(3-nitro-2-pyridinyl)sulfanyl]-4-(2-phenylethenyl)pyrimidine.
Chemical Property Profile of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine
Property Insights of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine
The XLogP value of 4.1014 indicates that 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine. Following Lipinski's Rule of Five, 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine 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-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine?
The CAS number of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine is 338420-95-4.
What is the molecular formula of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine?
The molecular formula of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine is C17H12N4O2S.
What is the molecular weight of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine?
The molecular weight of 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine is 336.07 g/mol.
Where can I buy 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine?
You can request a quote for 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Nitro-2-pyridinyl)sulfanyl]-4-styrylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.