4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
TL;DR: 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide (CAS 329063-95-8) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-(oxolan-2-ylmethyl)benzamide
Also Known As: 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide, 4-nitro-N-(oxolan-2-ylmethyl)benzamide, 4-Nitro-N-((tetrahydrofuran-2-yl)methyl)benzamide, Benzamide, N-tetrahydrofurfuryl-4-nitro-, 4-nitro-N-[(oxolan-2-yl)methyl]benzamide
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 329063-95-8 |
|---|---|
| SMILES | C1CC(OC1)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ZIDAIXFZQZFHDE-UHFFFAOYSA-N |
Product Overview
4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide (CAS 329063-95-8), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: 4-nitro-N-(oxolan-2-ylmethyl)benzamide.
Chemical Property Profile of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
Property Insights of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide. Following Lipinski's Rule of Five, 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide 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 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
The CAS number of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide is 329063-95-8.
What is the molecular formula of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
The molecular formula of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide is C12H14N2O4.
What is the molecular weight of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
The molecular weight of 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide is 250.10 g/mol.
Where can I buy 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
You can request a quote for 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.