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Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-
TL;DR: Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- (CAS 62390-80-1) is a chemical compound with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-(1-methylsulfanyl-2-nitroethenyl)aniline
Also Known As: Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-, 4-methoxy-N-(1-methylsulfanyl-2-nitroethenyl)aniline, 4-methoxy-N-[1-(methylsulfanyl)-2-nitrovinyl]aniline, 4-methoxy-N-(1-methylsulfanyl-2-nitro-vinyl)aniline, 4-METHOXY-N-[1-(METHYLSULFANYL)-2-NITROETHENYL]ANILINE
| Molecular Formula | C10H12N2O3S |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 2.5457 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.05687 |
| Heavy Atoms | 16 |
| Complexity | 389.55554 |
Chemical Identifiers
| CAS Number | 62390-80-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=C[N+](=O)[O-])SC |
Product Overview
Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- (CAS 62390-80-1), with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol. IUPAC: 4-methoxy-N-(1-methylsulfanyl-2-nitroethenyl)aniline.
Chemical Property Profile of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-
Property Insights of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-
The XLogP value of 2.5457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-. Following Lipinski's Rule of Five, Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- has 1 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 Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-?
The CAS number of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- is 62390-80-1.
What is the molecular formula of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-?
The molecular formula of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- is C10H12N2O3S.
What is the molecular weight of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-?
The molecular weight of Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- is 240.06 g/mol.
Where can I buy Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-?
You can request a quote for Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 4-methoxy-N-[1-(methylthio)-2-nitroethenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.