3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline
TL;DR: 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline (CAS 5453-91-8) is a chemical compound with molecular formula C16H13Cl2N3O and molecular weight 333.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,5-bis(4-chlorophenyl)-3,4-dihydropyrazole-2-carboxamide
Also Known As: 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline, N,3-Bis(4-chlorophenyl)-4,5-dihydro-1H-pyrazole-1-carboxamide, 4,5-Dihydro-N,3-bis(4-chlorophenyl)-1H-pyrazole-1-carboxamide, N,5-bis(4-chlorophenyl)-3,4-dihydropyrazole-2-carboxamide, 1H-Pyrazole-1-carboxamide, 4,5-dihydro-N,3-bis(4-chlorophenyl)-
| Molecular Formula | C16H13Cl2N3O |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.04358 |
| Heavy Atoms | 22 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 5453-91-8 |
|---|---|
| SMILES | C1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl |
| InChIKey | NNBDFLDCQOWNKZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline (CAS 5453-91-8), with molecular formula C16H13Cl2N3O and molecular weight 333.04 g/mol. IUPAC: N,5-bis(4-chlorophenyl)-3,4-dihydropyrazole-2-carboxamide.
Chemical Property Profile of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline
Property Insights of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline
The XLogP value of 3.8 indicates that 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline 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 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline?
The CAS number of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline is 5453-91-8.
What is the molecular formula of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline?
The molecular formula of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline is C16H13Cl2N3O.
What is the molecular weight of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline?
The molecular weight of 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline is 333.04 g/mol.
Where can I buy 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline?
You can request a quote for 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-1-(4-chlorophenylcarbamoyl)-2-pyrazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.