![2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine structure](/static/products/4000/400081-55-2.webp)
2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine
TL;DR: 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine (CAS 400081-55-2) is a chemical compound with molecular formula C10H13N5O3 and molecular weight 251.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-methoxyanilino)-2-nitroethenyl]guanidine
Also Known As: N-[1-(4-methoxyanilino)-2-nitrovinyl]guanidine, 2-[1-(4-methoxyanilino)-2-nitroethenyl]guanidine, 2-[1-[(4-methoxyphenyl)amino]-2-nitro-ethenyl]guanidine
| Molecular Formula | C10H13N5O3 |
|---|---|
| Molecular Weight | 251.10 g/mol |
| LogP | 0.4561 |
| Topological Polar Surface Area | 128.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.10184 |
| Heavy Atoms | 18 |
| Complexity | 476.79144 |
Chemical Identifiers
| CAS Number | 400081-55-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=C[N+](=O)[O-])N=C(N)N |
Product Overview
2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine (CAS 400081-55-2), with molecular formula C10H13N5O3 and molecular weight 251.10 g/mol. IUPAC: 2-[1-(4-methoxyanilino)-2-nitroethenyl]guanidine.
Chemical Property Profile of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine
Property Insights of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine
The XLogP value of 0.4561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine. The TPSA of 128.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine. Following Lipinski's Rule of Five, 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine has 3 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 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine?
The CAS number of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine is 400081-55-2.
What is the molecular formula of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine?
The molecular formula of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine is C10H13N5O3.
What is the molecular weight of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine?
The molecular weight of 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine is 251.10 g/mol.
Where can I buy 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine?
You can request a quote for 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(4-Methoxyanilino)-2-nitroethenyl]guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.