![2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate structure](/static/products/6705/67056-35-3.webp)
2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate
TL;DR: 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate (CAS 67056-35-3) is a chemical compound with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethyl-6-oxopyrano[3,2-d]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate
Also Known As: 2-(3,4-dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate, 2-(3,4-dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methy, 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1(6H)-yl)ethyl 4-methylbenzene-1-sulfonate
| Molecular Formula | C17H18N2O5S |
|---|---|
| Molecular Weight | 362.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.09363 |
| Heavy Atoms | 25 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 67056-35-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCN2C3=C(C(=CC(=O)O3)C)C(=N2)C |
| InChIKey | AQPVOWZIJXWDFQ-UHFFFAOYSA-N |
Product Overview
2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate (CAS 67056-35-3), with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol. IUPAC: 2-(3,4-dimethyl-6-oxopyrano[3,2-d]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate.
Chemical Property Profile of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate
Property Insights of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate has 0 hydrogen bond donor(s) and 6 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-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate?
The CAS number of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate is 67056-35-3.
What is the molecular formula of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate?
The molecular formula of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate is C17H18N2O5S.
What is the molecular weight of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate?
The molecular weight of 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate is 362.09 g/mol.
Where can I buy 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate?
You can request a quote for 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethyl-6-oxopyrano[2,3-c]pyrazol-1-yl)ethyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.