Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide
TL;DR: Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide (CAS 62970-62-1) is a chemical compound with molecular formula C13H16N4O2 and molecular weight 260.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyanoethyl)-4-oxo-4-(2-phenylhydrazinyl)butanamide
Also Known As: BUTANOIC ACID, 4-((2-CYANOETHYL)AMINO)-4-OXO-, 2-PHENYLHYDRAZIDE, 4-((2-Cyanoethyl)amino)-4-oxobutanoic acid 2-phenylhydrazide, N-(2-cyanoethyl)-4-oxo-4-(2-phenylhydrazinyl)butanamide, N-(2-Cyanoethyl)-4-oxo-4-(2-phenylhydrazin-1-yl)butanamide, BRN 0925646
| Molecular Formula | C13H16N4O2 |
|---|---|
| Molecular Weight | 260.13 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 94.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 260.12732 |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 62970-62-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NNC(=O)CCC(=O)NCCC#N |
| InChIKey | DWMGLKHRUKRNSJ-UHFFFAOYSA-N |
Product Overview
Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide (CAS 62970-62-1), with molecular formula C13H16N4O2 and molecular weight 260.13 g/mol. IUPAC: N-(2-cyanoethyl)-4-oxo-4-(2-phenylhydrazinyl)butanamide.
Chemical Property Profile of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide
Property Insights of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide. Following Lipinski's Rule of Five, Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide has 3 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 Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide?
The CAS number of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide is 62970-62-1.
What is the molecular formula of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide?
The molecular formula of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide is C13H16N4O2.
What is the molecular weight of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide?
The molecular weight of Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide is 260.13 g/mol.
Where can I buy Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide?
You can request a quote for Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 4-((2-cyanoethyl)amino)-4-oxo-, 2-phenylhydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.