4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide
TL;DR: 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide (CAS 514220-48-5) is a chemical compound with molecular formula C19H18BrN5O and molecular weight 411.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-1-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-5-carboxamide
Also Known As: 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide, 4-bromo-1-methyl-N'-[4-(methylanilino)benzylidene]-1H-pyrazole-5-carbohydrazide, 4-bromo-1-methyl-N'-[(E)-{4-[methyl(phenyl)amino]phenyl}methylidene]-1H-pyrazole-5-carbohydrazide, 4-BROMO-1-METHYL-N'-{(E)-1-[4-(METHYLANILINO)PHENYL]METHYLIDENE}-1H-PYRAZOLE-5-CARBOHYDRAZIDE
| Molecular Formula | C19H18BrN5O |
|---|---|
| Molecular Weight | 411.07 g/mol |
| LogP | 3.7144 |
| Topological Polar Surface Area | 62.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.06946 |
| Heavy Atoms | 26 |
| Complexity | 899.36237 |
Chemical Identifiers
| CAS Number | 514220-48-5 |
|---|---|
| SMILES | CN1C(=C(C=N1)Br)C(=O)N/N=C/C2=CC=C(C=C2)N(C)C3=CC=CC=C3 |
Product Overview
4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide (CAS 514220-48-5), with molecular formula C19H18BrN5O and molecular weight 411.07 g/mol. IUPAC: 4-bromo-1-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-5-carboxamide.
Chemical Property Profile of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide
Property Insights of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide
The XLogP value of 3.7144 indicates that 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide 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 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide?
The CAS number of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide is 514220-48-5.
What is the molecular formula of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide?
The molecular formula of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide is C19H18BrN5O.
What is the molecular weight of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide?
The molecular weight of 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide is 411.07 g/mol.
Where can I buy 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide?
You can request a quote for 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-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-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-2-methyl-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.