![2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- structure](/static/products/118/118429-46-2.png)
2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-
TL;DR: 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- (CAS 118429-46-2) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-1-(4-methylphenyl)sulfonylpyrrolidin-2-one
Also Known As: 1-Tosyl-5-methyl-2-pyrrolizinone, 1-Tosyl-5-methylpyrrolidine-2-one, J2.338.318G, 1-(4-methylphenyl)sulfonyl-5-methyl-2-pyrrolidinone, 5-Methyl-1-[(4-methylphenyl)sulfonyl]-2-pyrrolidinone
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 118429-46-2 |
|---|---|
| SMILES | CC1CCC(=O)N1S(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | KPQWUEGGQXKYOT-UHFFFAOYSA-N |
Product Overview
2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- (CAS 118429-46-2), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: 5-methyl-1-(4-methylphenyl)sulfonylpyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-
Property Insights of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- has 0 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 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-?
The CAS number of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- is 118429-46-2.
What is the molecular formula of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-?
The molecular formula of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- is C12H15NO3S.
What is the molecular weight of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-?
The molecular weight of 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- is 253.08 g/mol.
Where can I buy 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-?
You can request a quote for 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 5-methyl-1-[(4-methylphenyl)sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.