(4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone
TL;DR: (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone (CAS 956782-06-2) is a chemical compound with molecular formula C13H12ClN3O3 and molecular weight 293.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-(4-nitro-3-propylpyrazol-1-yl)methanone
Also Known As: 1-(4-chlorobenzoyl)-4-nitro-3-propyl-1H-pyrazole, (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone, (4-chlorophenyl)-(4-nitro-3-propylpyrazol-1-yl)methanone, 1-(4-chlorobenzoyl)-4-nitro-3-propylpyrazole, (4-chlorophenyl)-(4-nitro-3-propyl-pyrazol-1-yl)methanone
| Molecular Formula | C13H12ClN3O3 |
|---|---|
| Molecular Weight | 293.06 g/mol |
| LogP | 3.0857 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.05673 |
| Heavy Atoms | 20 |
| Complexity | 649.38104 |
Chemical Identifiers
| CAS Number | 956782-06-2 |
|---|---|
| SMILES | CCCC1=NN(C=C1[N+](=O)[O-])C(=O)C2=CC=C(C=C2)Cl |
Product Overview
(4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone (CAS 956782-06-2), with molecular formula C13H12ClN3O3 and molecular weight 293.06 g/mol. IUPAC: (4-chlorophenyl)-(4-nitro-3-propylpyrazol-1-yl)methanone.
Chemical Property Profile of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone
Property Insights of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone
The XLogP value of 3.0857 indicates that (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone. Following Lipinski's Rule of Five, (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone has 0 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-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone?
The CAS number of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone is 956782-06-2.
What is the molecular formula of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone?
The molecular formula of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone is C13H12ClN3O3.
What is the molecular weight of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone?
The molecular weight of (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone is 293.06 g/mol.
Where can I buy (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone?
You can request a quote for (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-chlorophenyl)(4-nitro-3-propyl-1H-pyrazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.