N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide
TL;DR: N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide (CAS 312703-99-4) is a chemical compound with molecular formula C13H12N2O4 and molecular weight 260.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide
Also Known As: N-furfuryl-6-nitro-2-toluamide, N-[(furan-2-yl)methyl]-2-methyl-3-nitrobenzamide, N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide, N-Furan-2-ylmethyl-2-methyl-3-nitro-benzamide, BAS 00463942
| Molecular Formula | C13H12N2O4 |
|---|---|
| Molecular Weight | 260.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.0797 |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 312703-99-4 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=CC=CO2 |
| InChIKey | PJVJJNVITAUWGX-UHFFFAOYSA-N |
Product Overview
N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide (CAS 312703-99-4), with molecular formula C13H12N2O4 and molecular weight 260.08 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide.
Chemical Property Profile of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide
Property Insights of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide has 1 hydrogen bond donor(s) and 4 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 N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide?
The CAS number of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide is 312703-99-4.
What is the molecular formula of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide?
The molecular formula of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide is C13H12N2O4.
What is the molecular weight of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide?
The molecular weight of N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide is 260.08 g/mol.
Where can I buy N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide?
You can request a quote for N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(furan-2-ylmethyl)-2-methyl-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.