ChemDiv1_015510
TL;DR: ChemDiv1_015510 (CAS 451504-11-3) is a chemical compound with molecular formula C23H20BrF2N3O3S and molecular weight 535.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-4-fluoro-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide
Also Known As: ChemDiv1_015510, F0917-0885, N-(4-bromophenyl)-4-fluoro-3-((4-(4-fluorophenyl)piperazin-1-yl)sulfonyl)benzamide, N-(4-bromophenyl)-4-fluoro-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide, N-(4-bromophenyl)-4-fluoro-3-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}benzamide
| Molecular Formula | C23H20BrF2N3O3S |
|---|---|
| Molecular Weight | 535.04 g/mol |
| LogP | 4.4905 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 535.03766 |
| Heavy Atoms | 33 |
| Complexity | 1261.114 |
Chemical Identifiers
| CAS Number | 451504-11-3 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)Br)F |
Product Overview
ChemDiv1_015510 (CAS 451504-11-3), with molecular formula C23H20BrF2N3O3S and molecular weight 535.04 g/mol. IUPAC: N-(4-bromophenyl)-4-fluoro-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide.
Chemical Property Profile of ChemDiv1_015510
Property Insights of ChemDiv1_015510
The XLogP value of 4.4905 indicates that ChemDiv1_015510 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_015510. Following Lipinski's Rule of Five, ChemDiv1_015510 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_015510?
The CAS number of ChemDiv1_015510 is 451504-11-3.
What is the molecular formula of ChemDiv1_015510?
The molecular formula of ChemDiv1_015510 is C23H20BrF2N3O3S.
What is the molecular weight of ChemDiv1_015510?
The molecular weight of ChemDiv1_015510 is 535.04 g/mol.
Where can I buy ChemDiv1_015510?
You can request a quote for ChemDiv1_015510 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_015510?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_015510 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.