PDSP1_001374
TL;DR: PDSP1_001374 (CAS 219963-52-7) is a chemical compound with molecular formula C17H18Br2FN3O3S and molecular weight 520.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dibromo-3-fluorophenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide
Also Known As: PDSP1_001374, PDSP2_001358, N-(2,5-dibromo-3-fluorophenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide, J1.464.712K, N-(2,5-dibromo-3-fluorophenyl)-4-methoxy-3-(piperazin-1-yl)benzene-1-sulfonamide
| Molecular Formula | C17H18Br2FN3O3S |
|---|---|
| Molecular Weight | 520.94 g/mol |
| LogP | 3.5697 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 520.94196 |
| Heavy Atoms | 27 |
| Complexity | 950.68005 |
Chemical Identifiers
| CAS Number | 219963-52-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C(=CC(=C2)Br)F)Br)N3CCNCC3 |
Product Overview
PDSP1_001374 (CAS 219963-52-7), with molecular formula C17H18Br2FN3O3S and molecular weight 520.94 g/mol. IUPAC: N-(2,5-dibromo-3-fluorophenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide.
Chemical Property Profile of PDSP1_001374
Property Insights of PDSP1_001374
The XLogP value of 3.5697 indicates that PDSP1_001374 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for PDSP1_001374. Following Lipinski's Rule of Five, PDSP1_001374 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PDSP1_001374?
The CAS number of PDSP1_001374 is 219963-52-7.
What is the molecular formula of PDSP1_001374?
The molecular formula of PDSP1_001374 is C17H18Br2FN3O3S.
What is the molecular weight of PDSP1_001374?
The molecular weight of PDSP1_001374 is 520.94 g/mol.
Where can I buy PDSP1_001374?
You can request a quote for PDSP1_001374 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PDSP1_001374?
Yes, KEHONG BIO provides custom synthesis services for PDSP1_001374 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.