3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide
TL;DR: 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide (CAS 27280-97-3) is a chemical compound with molecular formula C8H13N3O2S and molecular weight 215.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-amine
Also Known As: BENZOYL CYANIDE, 1-(1,1-DIOXIDOTETRAHYDRO-3-THIENYL)-3-METHYL-1H-PYRAZOL-5-AMINE, 1-(1,1-dioxidotetrahydrothien-3-yl)-3-methyl-1H-pyrazol-5-amine, 2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-amine, Y-1792
| Molecular Formula | C8H13N3O2S |
|---|---|
| Molecular Weight | 215.07 g/mol |
| LogP | 0.13332 |
| Topological Polar Surface Area | 77.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.07285 |
| Heavy Atoms | 14 |
| Complexity | 449.1515 |
Chemical Identifiers
| CAS Number | 27280-97-3 |
|---|---|
| SMILES | CC1=NN(C(=C1)N)C2CCS(=O)(=O)C2 |
Product Overview
3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide (CAS 27280-97-3), with molecular formula C8H13N3O2S and molecular weight 215.07 g/mol. IUPAC: 2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-amine.
Chemical Property Profile of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide
Property Insights of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide
The XLogP value of 0.13332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide. The TPSA of 77.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide. Following Lipinski's Rule of Five, 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide has 1 hydrogen bond donor(s) and 4 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 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide?
The CAS number of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide is 27280-97-3.
What is the molecular formula of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide?
The molecular formula of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide is C8H13N3O2S.
What is the molecular weight of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide?
The molecular weight of 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide is 215.07 g/mol.
Where can I buy 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide?
You can request a quote for 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-amino-3-methyl-1H-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.