![4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide structure](/static/products/515/515176-57-5.png)
4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide
TL;DR: 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide (CAS 515176-57-5) is a chemical compound with molecular formula C12H10ClN5O3 and molecular weight 307.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-5-carboxamide
Also Known As: 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide, 4-chloro-N'-{4-nitrobenzylidene}-1-methyl-1H-pyrazole-5-carbohydrazide, 4-chloro-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide, N-[(1E)-2-(4-nitrophenyl)-1-azavinyl](4-chloro-1-methylpyrazol-5-yl)carboxamid e
| Molecular Formula | C12H10ClN5O3 |
|---|---|
| Molecular Weight | 307.05 g/mol |
| LogP | 1.7456 |
| Topological Polar Surface Area | 102.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.0472 |
| Heavy Atoms | 21 |
| Complexity | 688.68304 |
Chemical Identifiers
| CAS Number | 515176-57-5 |
|---|---|
| SMILES | CN1C(=C(C=N1)Cl)C(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide (CAS 515176-57-5), with molecular formula C12H10ClN5O3 and molecular weight 307.05 g/mol. IUPAC: 4-chloro-1-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-5-carboxamide.
Chemical Property Profile of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide
Property Insights of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide
The XLogP value of 1.7456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide. The TPSA of 102.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide has 1 hydrogen bond donor(s) and 5 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-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide?
The CAS number of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide is 515176-57-5.
What is the molecular formula of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide?
The molecular formula of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide is C12H10ClN5O3.
What is the molecular weight of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide?
The molecular weight of 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide is 307.05 g/mol.
Where can I buy 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide?
You can request a quote for 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)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-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.