ChemDiv1_014630
TL;DR: ChemDiv1_014630 (CAS 450337-29-8) is a chemical compound with molecular formula C25H18FN3O4S and molecular weight 475.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzoyl-N-[2-(4-fluorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: ChemDiv1_014630, F0541-0755, 4-benzoyl-N-(2-(4-fluorophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 4-benzoyl-N-[2-(4-fluorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 4-benzoyl-N-[2-(4-fluorophenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C25H18FN3O4S |
|---|---|
| Molecular Weight | 475.10 g/mol |
| LogP | 3.9231 |
| Topological Polar Surface Area | 98.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.10022 |
| Heavy Atoms | 34 |
| Complexity | 1511.1414 |
Chemical Identifiers
| CAS Number | 450337-29-8 |
|---|---|
| SMILES | C1C2=C(N(N=C2CS1(=O)=O)C3=CC=C(C=C3)F)NC(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5 |
Product Overview
ChemDiv1_014630 (CAS 450337-29-8), with molecular formula C25H18FN3O4S and molecular weight 475.10 g/mol. IUPAC: 4-benzoyl-N-[2-(4-fluorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of ChemDiv1_014630
Property Insights of ChemDiv1_014630
The XLogP value of 3.9231 indicates that ChemDiv1_014630 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014630. Following Lipinski's Rule of Five, ChemDiv1_014630 has 1 hydrogen bond donor(s) and 5 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 ChemDiv1_014630?
The CAS number of ChemDiv1_014630 is 450337-29-8.
What is the molecular formula of ChemDiv1_014630?
The molecular formula of ChemDiv1_014630 is C25H18FN3O4S.
What is the molecular weight of ChemDiv1_014630?
The molecular weight of ChemDiv1_014630 is 475.10 g/mol.
Where can I buy ChemDiv1_014630?
You can request a quote for ChemDiv1_014630 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014630?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014630 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.