Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-
TL;DR: Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- (CAS 68345-55-1) is a chemical compound with molecular formula C10H7N3O3S and molecular weight 249.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(E)-2-nitroethenyl]furan-2-yl]sulfanylpyrimidine
Also Known As: Furan,2- -5- -, Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-, AE-641/00849002, 2-[(5-{2-nitrovinyl}-2-furyl)sulfanyl]pyrimidine, 2-[5-[(E)-2-nitroethenyl]furan-2-yl]sulfanylpyrimidine
| Molecular Formula | C10H7N3O3S |
|---|---|
| Molecular Weight | 249.02 g/mol |
| LogP | 2.4682 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.02081 |
| Heavy Atoms | 17 |
| Complexity | 538.73895 |
Chemical Identifiers
| CAS Number | 68345-55-1 |
|---|---|
| SMILES | C1=CN=C(N=C1)SC2=CC=C(O2)/C=C/[N+](=O)[O-] |
Product Overview
Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- (CAS 68345-55-1), with molecular formula C10H7N3O3S and molecular weight 249.02 g/mol. IUPAC: 2-[5-[(E)-2-nitroethenyl]furan-2-yl]sulfanylpyrimidine.
Chemical Property Profile of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-
Property Insights of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-
The XLogP value of 2.4682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-. Following Lipinski's Rule of Five, Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- 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 Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-?
The CAS number of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- is 68345-55-1.
What is the molecular formula of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-?
The molecular formula of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- is C10H7N3O3S.
What is the molecular weight of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-?
The molecular weight of Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- is 249.02 g/mol.
Where can I buy Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-?
You can request a quote for Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Furan, 2-(2-nitroethenyl)-5-(2-pyrimidylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.