(E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide
TL;DR: (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide (CAS 307320-58-7) is a chemical compound with molecular formula C22H26N4O and molecular weight 362.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-adamantyl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide
Also Known As: (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide, F1092-0741, 3-(adamantan-1-yl)-N'-[(1E)-(4-methylphenyl)methylidene]-1H-pyrazole-5-carbohydrazide, 5-(1-adamantyl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide, 5-ADAMANTAN-1-YL-2H-PYRAZOLE-3-CARBOXYLIC ACID (4-METHYL-BENZYLIDENE)-HYDRAZIDE
| Molecular Formula | C22H26N4O |
|---|---|
| Molecular Weight | 362.21 g/mol |
| LogP | 3.94982 |
| Topological Polar Surface Area | 70.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.21066 |
| Heavy Atoms | 27 |
| Complexity | 844.6885 |
Chemical Identifiers
| CAS Number | 307320-58-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=N/NC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4 |
Product Overview
(E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide (CAS 307320-58-7), with molecular formula C22H26N4O and molecular weight 362.21 g/mol. IUPAC: 5-(1-adamantyl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide.
Chemical Property Profile of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide
Property Insights of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide
The XLogP value of 3.94982 indicates that (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.14 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide 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 (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide?
The CAS number of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide is 307320-58-7.
What is the molecular formula of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide?
The molecular formula of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide is C22H26N4O.
What is the molecular weight of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide?
The molecular weight of (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide is 362.21 g/mol.
Where can I buy (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide?
You can request a quote for (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-((1S,3s)-adamantan-1-yl)-N'-(4-methylbenzylidene)-1H-pyrazole-5-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.