N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide
TL;DR: N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide (CAS 494218-36-9) is a chemical compound with molecular formula C14H15BrN4OS and molecular weight 366.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide
Also Known As: N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide, N-(2-bromo-4-methylphenyl)-N'-[(1-ethyl-1H-pyrazol-4-yl)carbonyl]thiourea, N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethyl-1H-pyrazole-4-carboxamide, N-[(2-bromo-4-methyl-phenyl)thiocarbamoyl]-1-ethyl-pyrazole-4-carboxamide
| Molecular Formula | C14H15BrN4OS |
|---|---|
| Molecular Weight | 366.01 g/mol |
| LogP | 3.10072 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.01498 |
| Heavy Atoms | 21 |
| Complexity | 683.3636 |
Chemical Identifiers
| CAS Number | 494218-36-9 |
|---|---|
| SMILES | CCN1C=C(C=N1)C(=O)NC(=S)NC2=C(C=C(C=C2)C)Br |
Product Overview
N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide (CAS 494218-36-9), with molecular formula C14H15BrN4OS and molecular weight 366.01 g/mol. IUPAC: N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide.
Chemical Property Profile of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide
Property Insights of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide
The XLogP value of 3.10072 indicates that N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.95 Ų, N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide 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
Frequently Asked Questions
What is the CAS number of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide?
The CAS number of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide is 494218-36-9.
What is the molecular formula of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide?
The molecular formula of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide is C14H15BrN4OS.
What is the molecular weight of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide?
The molecular weight of N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide is 366.01 g/mol.
Where can I buy N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide?
You can request a quote for N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethylpyrazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.