N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide
TL;DR: N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide (CAS 51883-91-1) is a chemical compound with molecular formula C14H16N4O2 and molecular weight 272.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide
Also Known As: N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide, N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxyben, N-[(E)-Amino(3,5-dimethyl-1H-pyrazol-1-yl)methylidene]-4-methoxybenzamide
| Molecular Formula | C14H16N4O2 |
|---|---|
| Molecular Weight | 272.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.12732 |
| Heavy Atoms | 20 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 51883-91-1 |
|---|---|
| SMILES | CC1=CC(=NN1C(=NC(=O)C2=CC=C(C=C2)OC)N)C |
| InChIKey | UIEIRVRRFXMAJW-UHFFFAOYSA-N |
Product Overview
N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide (CAS 51883-91-1), with molecular formula C14H16N4O2 and molecular weight 272.13 g/mol. IUPAC: N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide.
Chemical Property Profile of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide
Property Insights of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide. Following Lipinski's Rule of Five, N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide has 1 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-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide?
The CAS number of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide is 51883-91-1.
What is the molecular formula of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide?
The molecular formula of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide is C14H16N4O2.
What is the molecular weight of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide?
The molecular weight of N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide is 272.13 g/mol.
Where can I buy N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide?
You can request a quote for N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.