2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
TL;DR: 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide (CAS 347309-85-7) is a chemical compound with molecular formula C13H15N3O6 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3,5-dinitro-N-(oxolan-2-ylmethyl)benzamide
Also Known As: 2-methyl-3,5-dinitro-N-(oxolan-2-ylmethyl)benzamide, 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide, (2-methyl-3,5-dinitrophenyl)-N-(oxolan-2-ylmethyl)carboxamide, 2-METHYL-3,5-DINITRO-N-(TETRAHYDRO-2-FURANYLMETHYL)BENZAMIDE
| Molecular Formula | C13H15N3O6 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 1.72022 |
| Topological Polar Surface Area | 124.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.0961 |
| Heavy Atoms | 22 |
| Complexity | 624.4466 |
Chemical Identifiers
| CAS Number | 347309-85-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCC2CCCO2 |
Product Overview
2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide (CAS 347309-85-7), with molecular formula C13H15N3O6 and molecular weight 309.10 g/mol. IUPAC: 2-methyl-3,5-dinitro-N-(oxolan-2-ylmethyl)benzamide.
Chemical Property Profile of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
Property Insights of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
The XLogP value of 1.72022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide. The TPSA of 124.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide. Following Lipinski's Rule of Five, 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide has 1 hydrogen bond donor(s) and 6 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-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
The CAS number of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide is 347309-85-7.
What is the molecular formula of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
The molecular formula of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide is C13H15N3O6.
What is the molecular weight of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
The molecular weight of 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide is 309.10 g/mol.
Where can I buy 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
You can request a quote for 2-methyl-3,5-dinitro-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 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-3,5-dinitro-N-(tetrahydrofuran-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.