4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide
TL;DR: 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide (CAS 313981-41-8) is a chemical compound with molecular formula C13H16N2O4 and molecular weight 264.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide
Also Known As: 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide, BAS 00624050, BIM-0018879.P001, 4-Methyl-3-nitro-N-(tetrahydro-furan-2-ylmethyl)-benzamide, AB00081962-01
| Molecular Formula | C13H16N2O4 |
|---|---|
| Molecular Weight | 264.11 g/mol |
| LogP | 1.81202 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.111 |
| Heavy Atoms | 19 |
| Complexity | 495.41663 |
Chemical Identifiers
| CAS Number | 313981-41-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC2CCCO2)[N+](=O)[O-] |
Product Overview
4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide (CAS 313981-41-8), with molecular formula C13H16N2O4 and molecular weight 264.11 g/mol. IUPAC: 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide.
Chemical Property Profile of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide
Property Insights of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide
The XLogP value of 1.81202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide. Following Lipinski's Rule of Five, 4-methyl-3-nitro-N-(oxolan-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-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide?
The CAS number of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide is 313981-41-8.
What is the molecular formula of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide?
The molecular formula of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide is C13H16N2O4.
What is the molecular weight of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide?
The molecular weight of 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide is 264.11 g/mol.
Where can I buy 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide?
You can request a quote for 4-methyl-3-nitro-N-(oxolan-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-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.