1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)
TL;DR: 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) (CAS 86871-65-0) is a chemical compound with molecular formula C19H23N3O5 and molecular weight 373.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;5-phenyl-3-(2-pyrrolidin-1-ylethoxy)-1H-pyrazole
Also Known As: 3-Phenyl-5-pyrrolidinoethoxy-pyrazole maleate, 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1), 3-Phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-1H-pyrazole (Z)-2-butenedioate (1:1), (E)-but-2-enedioic acid; 5-phenyl-3-(2-pyrrolidin-1-ylethoxy)-1H-pyrazole, RefChem:1058475
| Molecular Formula | C19H23N3O5 |
|---|---|
| Molecular Weight | 373.16 g/mol |
| LogP | 2.2631 |
| Topological Polar Surface Area | 115.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 373.16376 |
| Heavy Atoms | 27 |
| Complexity | 735.71545 |
Chemical Identifiers
| CAS Number | 86871-65-0 |
|---|---|
| SMILES | C1CCN(C1)CCOC2=NNC(=C2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O |
Product Overview
1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) (CAS 86871-65-0), with molecular formula C19H23N3O5 and molecular weight 373.16 g/mol. IUPAC: (E)-but-2-enedioic acid;5-phenyl-3-(2-pyrrolidin-1-ylethoxy)-1H-pyrazole.
Chemical Property Profile of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)
Property Insights of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)
The XLogP value of 2.2631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1). The TPSA of 115.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1). Following Lipinski's Rule of Five, 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) has 3 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 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)?
The CAS number of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) is 86871-65-0.
What is the molecular formula of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)?
The molecular formula of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) is C19H23N3O5.
What is the molecular weight of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)?
The molecular weight of 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) is 373.16 g/mol.
Where can I buy 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)?
You can request a quote for 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole, 3-phenyl-5-(2-(1-pyrrolidinyl)ethoxy)-, (Z)-2-butenedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.