2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide
TL;DR: 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide (CAS 727675-40-3) is a chemical compound with molecular formula C11H12ClN3O and molecular weight 237.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-phenyl-3,4-dihydropyrazol-5-yl)acetamide
Also Known As: 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide, 2-chloro-N-(2-phenyl-3,4-dihydropyrazol-5-yl)acetamide, 2-chloro-N-(1-phenyl(2-pyrazolin-3-yl))acetamide, Acetamide, 2-chloro-N-(4,5-dihydro-1-phenyl-1H-pyrazol-3-yl)-, A3768/0159863
| Molecular Formula | C11H12ClN3O |
|---|---|
| Molecular Weight | 237.07 g/mol |
| LogP | 1.5652 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.0669 |
| Heavy Atoms | 16 |
| Complexity | 404.95053 |
Chemical Identifiers
| CAS Number | 727675-40-3 |
|---|---|
| SMILES | C1CN(N=C1NC(=O)CCl)C2=CC=CC=C2 |
Product Overview
2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide (CAS 727675-40-3), with molecular formula C11H12ClN3O and molecular weight 237.07 g/mol. IUPAC: 2-chloro-N-(2-phenyl-3,4-dihydropyrazol-5-yl)acetamide.
Chemical Property Profile of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide
Property Insights of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide
The XLogP value of 1.5652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide. With a topological polar surface area (TPSA) of 44.7 Ų, 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide 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 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide?
The CAS number of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide is 727675-40-3.
What is the molecular formula of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide?
The molecular formula of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide is C11H12ClN3O.
What is the molecular weight of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide?
The molecular weight of 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide is 237.07 g/mol.
Where can I buy 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide?
You can request a quote for 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.