4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide
TL;DR: 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide (CAS 957490-50-5) is a chemical compound with molecular formula C13H13BrN4O2 and molecular weight 336.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-1,3-dimethylpyrazole-5-carboxamide
Also Known As: 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide, 4-bromo-N'-(3-hydroxybenzylidene)-1,3-dimethyl-1H-pyrazole-5-carbohydrazide, 4-bromo-N'-[(E)-(3-hydroxyphenyl)methylidene]-1,3-dimethyl-1H-pyrazole-5-carbohydrazide, 4-BROMO-N'~5~-[(E)-1-(3-HYDROXYPHENYL)METHYLIDENE]-1,3-DIMETHYL-1H-PYRAZOLE-5-CARBOHYDRAZIDE
| Molecular Formula | C13H13BrN4O2 |
|---|---|
| Molecular Weight | 336.02 g/mol |
| LogP | 1.96052 |
| Topological Polar Surface Area | 79.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.0222 |
| Heavy Atoms | 20 |
| Complexity | 679.00586 |
Chemical Identifiers
| CAS Number | 957490-50-5 |
|---|---|
| SMILES | CC1=NN(C(=C1Br)C(=O)N/N=C/C2=CC(=CC=C2)O)C |
Product Overview
4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide (CAS 957490-50-5), with molecular formula C13H13BrN4O2 and molecular weight 336.02 g/mol. IUPAC: 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-1,3-dimethylpyrazole-5-carboxamide.
Chemical Property Profile of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide
Property Insights of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide
The XLogP value of 1.96052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide. The TPSA of 79.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide has 2 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 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide?
The CAS number of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide is 957490-50-5.
What is the molecular formula of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide?
The molecular formula of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide is C13H13BrN4O2.
What is the molecular weight of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide?
The molecular weight of 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide is 336.02 g/mol.
Where can I buy 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide?
You can request a quote for 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2,5-dimethylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.