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1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one
TL;DR: 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one (CAS 10234-64-7) is a chemical compound with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonylpyrazolidin-3-one
Also Known As: 1-tosylpyrazolidin-3-one, 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one, 1-(4-methylbenzenesulfonyl)pyrazolidin-3-one, 1-(4-methylphenyl)sulfonylpyrazolidin-3-one, 1-(p-tolylsulfonyl)pyrazolidin-3-one
| Molecular Formula | C10H12N2O3S |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 0.42062 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.05687 |
| Heavy Atoms | 16 |
| Complexity | 507.3706 |
Chemical Identifiers
| CAS Number | 10234-64-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)N2 |
Product Overview
1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one (CAS 10234-64-7), with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol. IUPAC: 1-(4-methylphenyl)sulfonylpyrazolidin-3-one.
Chemical Property Profile of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one
Property Insights of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one
The XLogP value of 0.42062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one has 1 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 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one?
The CAS number of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one is 10234-64-7.
What is the molecular formula of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one?
The molecular formula of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one is C10H12N2O3S.
What is the molecular weight of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one?
The molecular weight of 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one is 240.06 g/mol.
Where can I buy 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one?
You can request a quote for 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.