2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine
TL;DR: 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine (CAS 321574-16-7) is a chemical compound with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1-dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-5-amine
Also Known As: 2-(1,1-dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine, 3-[5-amino-4-(4-methoxyphenyl)-1H-pyrazol-1-yl]tetrahydro-1H-1lambda~6~-thiophene-1,1-dione, 3-[5-amino-4-(4-methoxyphenyl)-1H-pyrazol-1-yl]-1lambda6-thiolane-1,1-dione, 3-(5-Amino-4-(4-methoxyphenyl)-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide
| Molecular Formula | C14H17N3O3S |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 1.5005 |
| Topological Polar Surface Area | 87.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.09906 |
| Heavy Atoms | 21 |
| Complexity | 750.2715 |
Chemical Identifiers
| CAS Number | 321574-16-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(N(N=C2)C3CCS(=O)(=O)C3)N |
Product Overview
2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine (CAS 321574-16-7), with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol. IUPAC: 1-(1,1-dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-5-amine.
Chemical Property Profile of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine
Property Insights of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine
The XLogP value of 1.5005 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine. The TPSA of 87.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine. Following Lipinski's Rule of Five, 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine has 1 hydrogen bond donor(s) and 5 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-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine?
The CAS number of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine is 321574-16-7.
What is the molecular formula of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine?
The molecular formula of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine is C14H17N3O3S.
What is the molecular weight of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine?
The molecular weight of 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine is 307.10 g/mol.
Where can I buy 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine?
You can request a quote for 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,1-Dioxothiolan-3-yl)-4-(4-methoxyphenyl)pyrazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.