2'-Methoxy-5'-nitrobenzamil
TL;DR: 2'-Methoxy-5'-nitrobenzamil (CAS 122341-74-6) is a chemical compound with molecular formula C14H15ClN8O4 and molecular weight 394.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-diamino-6-chloro-N-[N'-[(2-methoxy-5-nitrophenyl)methyl]carbamimidoyl]pyrazine-2-carboxamide
Also Known As: MN-Benzamil, 2'-Methoxy-5'-nitrobenzamil, 2/'-Methoxy-5/'-nitrobenzamil, 3,5-Diamino-6-chloro-N-(imino(((2-methoxy-5-nitrophenyl)methyl)amino)methyl)pyrazinecarboxamide, 3,5-diamino-6-chloro-N-[N'-[(2-methoxy-5-nitrophenyl)methyl]carbamimidoyl]pyrazine-2-carboxamide
| Molecular Formula | C14H15ClN8O4 |
|---|---|
| Molecular Weight | 394.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.09048 |
| Heavy Atoms | 27 |
| Complexity | 574.0 |
Chemical Identifiers
| CAS Number | 122341-74-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])CN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N |
| InChIKey | FUWFKBHKVULDCP-UHFFFAOYSA-N |
Product Overview
2'-Methoxy-5'-nitrobenzamil (CAS 122341-74-6), with molecular formula C14H15ClN8O4 and molecular weight 394.09 g/mol. IUPAC: 3,5-diamino-6-chloro-N-[N'-[(2-methoxy-5-nitrophenyl)methyl]carbamimidoyl]pyrazine-2-carboxamide.
Chemical Property Profile of 2'-Methoxy-5'-nitrobenzamil
Property Insights of 2'-Methoxy-5'-nitrobenzamil
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Methoxy-5'-nitrobenzamil. The TPSA of 200.0 Ų indicates high polarity, suggesting 2'-Methoxy-5'-nitrobenzamil may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-Methoxy-5'-nitrobenzamil has 4 hydrogen bond donor(s) and 9 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'-Methoxy-5'-nitrobenzamil?
The CAS number of 2'-Methoxy-5'-nitrobenzamil is 122341-74-6.
What is the molecular formula of 2'-Methoxy-5'-nitrobenzamil?
The molecular formula of 2'-Methoxy-5'-nitrobenzamil is C14H15ClN8O4.
What is the molecular weight of 2'-Methoxy-5'-nitrobenzamil?
The molecular weight of 2'-Methoxy-5'-nitrobenzamil is 394.09 g/mol.
Where can I buy 2'-Methoxy-5'-nitrobenzamil?
You can request a quote for 2'-Methoxy-5'-nitrobenzamil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Methoxy-5'-nitrobenzamil?
Yes, KEHONG BIO provides custom synthesis services for 2'-Methoxy-5'-nitrobenzamil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.