1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole
TL;DR: 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole (CAS 15083-40-6) is a chemical compound with molecular formula C14H17ClN2O and molecular weight 264.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-(3-chloropropoxy)-3-methylpyrazole
Also Known As: 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole, B-328, 1-benzyl-5-(3-chloropropoxy)-3-methyl-1H-pyrazole, Pyrazole, 1-benzyl-5-(3-chloropropoxy)-3-methyl-, 5-23-10-00534 (Beilstein Handbook Reference)
| Molecular Formula | C14H17ClN2O |
|---|---|
| Molecular Weight | 264.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 27.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.10294 |
| Heavy Atoms | 18 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 15083-40-6 |
|---|---|
| SMILES | CC1=NN(C(=C1)OCCCCl)CC2=CC=CC=C2 |
| InChIKey | UTTUDDGSNFRBEK-UHFFFAOYSA-N |
Product Overview
1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole (CAS 15083-40-6), with molecular formula C14H17ClN2O and molecular weight 264.10 g/mol. IUPAC: 1-benzyl-5-(3-chloropropoxy)-3-methylpyrazole.
Chemical Property Profile of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole
Property Insights of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole
The XLogP value of 3.5 indicates that 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.1 Ų, 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole 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 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole?
The CAS number of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole is 15083-40-6.
What is the molecular formula of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole?
The molecular formula of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole is C14H17ClN2O.
What is the molecular weight of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole?
The molecular weight of 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole is 264.10 g/mol.
Where can I buy 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole?
You can request a quote for 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-5-(3-chloropropoxy)-3-methylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.