N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide
TL;DR: N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide (CAS 712292-79-0) is a chemical compound with molecular formula C12H13ClIN5O and molecular weight 404.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-butyltetrazol-5-yl)-2-chloro-5-iodobenzamide
Also Known As: N-(2-butyltetrazol-5-yl)-2-chloro-5-iodobenzamide, N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide, AP-970/42837693, N-(2-butyl-2H-tetrazol-5-yl)-2-chloro-5-iodobenzamide
| Molecular Formula | C12H13ClIN5O |
|---|---|
| Molecular Weight | 404.99 g/mol |
| LogP | 2.9835 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.98535 |
| Heavy Atoms | 20 |
| Complexity | 615.6452 |
Chemical Identifiers
| CAS Number | 712292-79-0 |
|---|---|
| SMILES | CCCCN1N=C(N=N1)NC(=O)C2=C(C=CC(=C2)I)Cl |
Product Overview
N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide (CAS 712292-79-0), with molecular formula C12H13ClIN5O and molecular weight 404.99 g/mol. IUPAC: N-(2-butyltetrazol-5-yl)-2-chloro-5-iodobenzamide.
Chemical Property Profile of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide
Property Insights of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide
The XLogP value of 2.9835 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide. Following Lipinski's Rule of Five, N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide 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-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide?
The CAS number of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide is 712292-79-0.
What is the molecular formula of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide?
The molecular formula of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide is C12H13ClIN5O.
What is the molecular weight of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide?
The molecular weight of N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide is 404.99 g/mol.
Where can I buy N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide?
You can request a quote for N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide 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-tetraazol-5-yl)-2-chloro-5-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-butyl-2H-tetraazol-5-yl)-2-chloro-5-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.