N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide
TL;DR: N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide (CAS 59074-27-0) is a chemical compound with molecular formula C22H17Cl2N3O and molecular weight 409.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,5-bis(4-chlorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide
Also Known As: Dodicin-sodium, N,3-Bis(4-chlorophenyl)-4-phenyl-4,5-dihydro-1H-pyrazole-1-carboxamide, 1-((4-Chlorophenyl)carbamoyl)-3-(4-chlorophenyl)-4-phenyl-2-pyrazoline, 1H-Pyrazole-1-carboxamide, 4,5-dihydro-N,3-bis(4-chlorophenyl)-4-phenyl-, 1H-Pyrazole-1-carboxamide, N,3-bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-
| Molecular Formula | C22H17Cl2N3O |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.07486 |
| Heavy Atoms | 28 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 59074-27-0 |
|---|---|
| SMILES | C1C(C(=NN1C(=O)NC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=CC=C4 |
| InChIKey | PJOQTCYFCXSJOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide (CAS 59074-27-0), with molecular formula C22H17Cl2N3O and molecular weight 409.07 g/mol. IUPAC: N,5-bis(4-chlorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide.
Chemical Property Profile of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide
Property Insights of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide
The XLogP value of 5.5 indicates that N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide?
The CAS number of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide is 59074-27-0.
What is the molecular formula of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide?
The molecular formula of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide is C22H17Cl2N3O.
What is the molecular weight of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide?
The molecular weight of N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide is 409.07 g/mol.
Where can I buy N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide?
You can request a quote for N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N,3-Bis(4-chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.