2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone
TL;DR: 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone (CAS 1003536-11-5) is a chemical compound with molecular formula C20H20ClN5O2 and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]tetrazol-2-yl]-1-pyrrolidin-1-ylethanone
Also Known As: 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone, 2-(5-{4-[(2-chlorobenzyl)oxy]phenyl}-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone, 2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]tetrazol-2-yl]-1-pyrrolidin-1-ylethanone
| Molecular Formula | C20H20ClN5O2 |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | 3.1949 |
| Topological Polar Surface Area | 73.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.13055 |
| Heavy Atoms | 28 |
| Complexity | 951.23975 |
Chemical Identifiers
| CAS Number | 1003536-11-5 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CN2N=C(N=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4Cl |
Product Overview
2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone (CAS 1003536-11-5), with molecular formula C20H20ClN5O2 and molecular weight 397.13 g/mol. IUPAC: 2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]tetrazol-2-yl]-1-pyrrolidin-1-ylethanone.
Chemical Property Profile of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone
Property Insights of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone
The XLogP value of 3.1949 indicates that 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone. Following Lipinski's Rule of Five, 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone has 0 hydrogen bond donor(s) and 5 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-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone?
The CAS number of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone is 1003536-11-5.
What is the molecular formula of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone?
The molecular formula of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone is C20H20ClN5O2.
What is the molecular weight of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone?
The molecular weight of 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone is 397.13 g/mol.
Where can I buy 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone?
You can request a quote for 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-(4-((2-chlorobenzyl)oxy)phenyl)-2H-tetrazol-2-yl)-1-(pyrrolidin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.