N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide
TL;DR: N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide (CAS 956183-13-4) is a chemical compound with molecular formula C16H20ClN3O and molecular weight 305.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-tert-butyl-1-phenylpyrazol-5-yl)-2-chloropropanamide
Also Known As: N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide, N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-chloropropanamide
| Molecular Formula | C16H20ClN3O |
|---|---|
| Molecular Weight | 305.13 g/mol |
| LogP | 3.7356 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.1295 |
| Heavy Atoms | 21 |
| Complexity | 626.7168 |
Chemical Identifiers
| CAS Number | 956183-13-4 |
|---|---|
| SMILES | CC(C(=O)NC1=CC(=NN1C2=CC=CC=C2)C(C)(C)C)Cl |
Product Overview
N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide (CAS 956183-13-4), with molecular formula C16H20ClN3O and molecular weight 305.13 g/mol. IUPAC: N-(3-tert-butyl-1-phenylpyrazol-5-yl)-2-chloropropanamide.
Chemical Property Profile of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide
Property Insights of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide
The XLogP value of 3.7356 indicates that N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide has 1 hydrogen bond donor(s) and 2 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-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide?
The CAS number of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide is 956183-13-4.
What is the molecular formula of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide?
The molecular formula of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide is C16H20ClN3O.
What is the molecular weight of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide?
The molecular weight of N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide is 305.13 g/mol.
Where can I buy N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide?
You can request a quote for N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-chloropropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.