N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide
TL;DR: N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide (CAS 1003425-52-2) is a chemical compound with molecular formula C13H16N6O4 and molecular weight 320.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-butyltetrazol-5-yl)-4-methoxy-3-nitrobenzamide
Also Known As: N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide, N-(2-butyltetrazol-5-yl)-4-methoxy-3-nitrobenzamide, N-(2-butyltetrazol-5-yl)-4-methoxy-3-nitro-benzamide
| Molecular Formula | C13H16N6O4 |
|---|---|
| Molecular Weight | 320.12 g/mol |
| LogP | 1.6423 |
| Topological Polar Surface Area | 125.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 320.1233 |
| Heavy Atoms | 23 |
| Complexity | 714.24036 |
Chemical Identifiers
| CAS Number | 1003425-52-2 |
|---|---|
| SMILES | CCCCN1N=C(N=N1)NC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-] |
Product Overview
N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide (CAS 1003425-52-2), with molecular formula C13H16N6O4 and molecular weight 320.12 g/mol. IUPAC: N-(2-butyltetrazol-5-yl)-4-methoxy-3-nitrobenzamide.
Chemical Property Profile of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide
Property Insights of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide
The XLogP value of 1.6423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide. The TPSA of 125.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide has 1 hydrogen bond donor(s) and 7 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-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide?
The CAS number of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide is 1003425-52-2.
What is the molecular formula of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide?
The molecular formula of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide is C13H16N6O4.
What is the molecular weight of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide?
The molecular weight of N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide is 320.12 g/mol.
Where can I buy N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide?
You can request a quote for N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-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-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-butyl-2H-tetrazol-5-yl)-4-methoxy-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.