Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-
TL;DR: Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- (CAS 73953-58-9) is a chemical compound with molecular formula C23H28N4O2S and molecular weight 424.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-pentoxyphenyl)thiourea
Also Known As: Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-, 1-p-n-Amyloxyphenyl-3-(4-antipyryl)-2-thiourea, 3-(4-Antipyrinyl)-1-(p-pentoxyphenyl)-2-thiourea, 5-25-14-00109 (Beilstein Handbook Reference), 3-Antipyrinyl-1-[4-(pentyloxy)phenyl]thiourea
| Molecular Formula | C23H28N4O2S |
|---|---|
| Molecular Weight | 424.19 g/mol |
| LogP | 4.86232 |
| Topological Polar Surface Area | 60.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 424.1933 |
| Heavy Atoms | 30 |
| Complexity | 1039.5602 |
Chemical Identifiers
| CAS Number | 73953-58-9 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C |
Product Overview
Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- (CAS 73953-58-9), with molecular formula C23H28N4O2S and molecular weight 424.19 g/mol. IUPAC: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-pentoxyphenyl)thiourea.
Chemical Property Profile of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-
Property Insights of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-
The XLogP value of 4.86232 indicates that Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-. Following Lipinski's Rule of Five, Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- has 2 hydrogen bond donor(s) and 3 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 Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-?
The CAS number of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- is 73953-58-9.
What is the molecular formula of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-?
The molecular formula of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- is C23H28N4O2S.
What is the molecular weight of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-?
The molecular weight of Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- is 424.19 g/mol.
Where can I buy Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-?
You can request a quote for Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 3-(4-antipyrinyl)-1-(p-pentoxyphenyl)-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.