(4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone
TL;DR: (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone (CAS 844453-23-2) is a chemical compound with molecular formula C27H30N4O3S2 and molecular weight 522.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-methyl-1-(2-methylphenyl)thieno[3,2-d]pyrazol-5-yl]-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methanone
Also Known As: (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone, [3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazol-5-yl](4-{[4-(propan-2-yl)phenyl]sulfonyl}piperazin-1-yl)methanone, [3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazol-5-yl]-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methanone
| Molecular Formula | C27H30N4O3S2 |
|---|---|
| Molecular Weight | 522.18 g/mol |
| LogP | 4.97394 |
| Topological Polar Surface Area | 75.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 522.1759 |
| Heavy Atoms | 36 |
| Complexity | 1527.001 |
Chemical Identifiers
| CAS Number | 844453-23-2 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)C)C(=N2)C |
Product Overview
(4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone (CAS 844453-23-2), with molecular formula C27H30N4O3S2 and molecular weight 522.18 g/mol. IUPAC: [3-methyl-1-(2-methylphenyl)thieno[3,2-d]pyrazol-5-yl]-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methanone.
Chemical Property Profile of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone
Property Insights of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone
The XLogP value of 4.97394 indicates that (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.51 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone. Following Lipinski's Rule of Five, (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone?
The CAS number of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone is 844453-23-2.
What is the molecular formula of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone?
The molecular formula of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone is C27H30N4O3S2.
What is the molecular weight of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone?
The molecular weight of (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone is 522.18 g/mol.
Where can I buy (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone?
You can request a quote for (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-((4-isopropylphenyl)sulfonyl)piperazin-1-yl)(3-methyl-1-(o-tolyl)-1H-thieno[2,3-c]pyrazol-5-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.