4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide
TL;DR: 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide (CAS 956392-63-5) is a chemical compound with molecular formula C15H18N4O3 and molecular weight 302.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitropyrazol-1-yl)-N-(1-phenylethyl)butanamide
Also Known As: 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide, 4-(4-nitropyrazolyl)-N-(phenylethyl)butanamide, 4-(4-nitropyrazol-1-yl)-N-(1-phenylethyl)butanamide, 4-Nitro-N-(1-phenylethyl)-1H-pyrazole-1-butanamide, A3780/0160425
| Molecular Formula | C15H18N4O3 |
|---|---|
| Molecular Weight | 302.14 g/mol |
| LogP | 2.4489 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.13788 |
| Heavy Atoms | 22 |
| Complexity | 639.24695 |
Chemical Identifiers
| CAS Number | 956392-63-5 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)CCCN2C=C(C=N2)[N+](=O)[O-] |
Product Overview
4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide (CAS 956392-63-5), with molecular formula C15H18N4O3 and molecular weight 302.14 g/mol. IUPAC: 4-(4-nitropyrazol-1-yl)-N-(1-phenylethyl)butanamide.
Chemical Property Profile of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide
Property Insights of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide
The XLogP value of 2.4489 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide. Following Lipinski's Rule of Five, 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide 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-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide?
The CAS number of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide is 956392-63-5.
What is the molecular formula of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide?
The molecular formula of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide is C15H18N4O3.
What is the molecular weight of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide?
The molecular weight of 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide is 302.14 g/mol.
Where can I buy 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide?
You can request a quote for 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.