Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-
TL;DR: Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- (CAS 5371-90-4) is a chemical compound with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-(2-chloroethoxy)-3-methylpyrazole
Also Known As: 1-Benzyl-5-(2-chloroethoxy)-3-methylpyrazole, B-312, Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-, 1-Benzyl-5- -3-methyl-1H-pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-1H-pyrazole
| Molecular Formula | C13H15ClN2O |
|---|---|
| Molecular Weight | 250.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 27.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.0873 |
| Heavy Atoms | 17 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 5371-90-4 |
|---|---|
| SMILES | CC1=NN(C(=C1)OCCCl)CC2=CC=CC=C2 |
| InChIKey | WYXRAKZFVVLFRK-UHFFFAOYSA-N |
Product Overview
Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- (CAS 5371-90-4), with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol. IUPAC: 1-benzyl-5-(2-chloroethoxy)-3-methylpyrazole.
Chemical Property Profile of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-
Property Insights of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-
The XLogP value of 3.1 indicates that Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.1 Ų, Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- has 0 hydrogen bond donor(s) and 2 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 Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-?
The CAS number of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- is 5371-90-4.
What is the molecular formula of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-?
The molecular formula of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- is C13H15ClN2O.
What is the molecular weight of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-?
The molecular weight of Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- is 250.09 g/mol.
Where can I buy Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-?
You can request a quote for Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazole, 1-benzyl-5-(2-chloroethoxy)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.