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5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide structure
Fine Chemical

5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide

TL;DR: 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide (CAS 127139-43-9) is a chemical compound with molecular formula C12H19N3O2S and molecular weight 269.1198 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-(butoxymethyl)-3-methyl-4,5-dihydrofuro[3,2-d]pyrazole-1-carbothioamide

Also Known As: BAS 00333752, 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide, 5-(butoxymethyl)-3-methyl-4,5-dihydrofuro[2,3-c]pyrazole-1-carbothioamide, 5-(BUTOXYMETHYL)-3-METHYL-1H,4H,5H-FURO[2,3-C]PYRAZOLE-1-CARBOTHIOAMIDE

CAS Number
127139-43-9
Molecular Formula
C12H19N3O2S
Molecular Weight
269.1198 g/mol
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Technical Specifications

Molecular FormulaC12H19N3O2S
Molecular Weight269.1198 g/mol
XLogP2.1
Topological Polar Surface Area (TPSA)94.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass269.1198 Da
Heavy Atoms18
Complexity303.0
SMILESCCCCOCC1CC2=C(O1)N(N=C2C)C(=S)N
InChIKeyZSPGOGOISCCQCX-UHFFFAOYSA-N

Chemical Property Profile of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide

XLogP
2.1
TPSA (Topological Polar Surface Area)
94.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
18
Complexity
303.0
Exact Mass
269.1198
Monoisotopic Mass
269.1198
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide

The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide. The TPSA of 94.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide. Following Lipinski's Rule of Five, 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide 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

What is the CAS number of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide?

The CAS number of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide is 127139-43-9.

What is the molecular formula of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide?

The molecular formula of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide is C12H19N3O2S.

What is the molecular weight of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide?

The molecular weight of 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide is 269.1198 g/mol.

Where can I buy 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide?

You can request a quote for 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide?

Yes, CoreyChem provides custom synthesis services for 5-(butoxymethyl)-3-methyl-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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