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1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea structure
Fine Chemical

1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

TL;DR: 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea (CAS 1005662-95-2) is a chemical compound with molecular formula C19H23BrN6S and molecular weight 446.08884 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

Also Known As: 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea, 1-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-3-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]thiourea, 1-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea, N-[2-(4-BROMO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)ETHYL]-N'-[1-(2-METHYLBENZYL)-1H-PYRAZOL-4-YL]THIOUREA

CAS Number
1005662-95-2
Molecular Formula
C19H23BrN6S
Molecular Weight
446.08884 g/mol
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Technical Specifications

Molecular FormulaC19H23BrN6S
Molecular Weight446.08884 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)91.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds6
Exact Mass446.08884 Da
Heavy Atoms27
Complexity495.0
SMILESCC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NCCN3C(=C(C(=N3)C)Br)C
InChIKeyIKHHGOJXWGKEEJ-UHFFFAOYSA-N

Chemical Property Profile of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

XLogP
3.2
TPSA (Topological Polar Surface Area)
91.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
6
Heavy Atoms
27
Complexity
495.0
Exact Mass
446.08884
Monoisotopic Mass
446.08884
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 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

The XLogP value of 3.2 indicates that 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea. Following Lipinski's Rule of Five, 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea?

The CAS number of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea is 1005662-95-2.

What is the molecular formula of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea?

The molecular formula of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea is C19H23BrN6S.

What is the molecular weight of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea?

The molecular weight of 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea is 446.08884 g/mol.

Where can I buy 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea?

You can request a quote for 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea?

Yes, CoreyChem provides custom synthesis services for 1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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