ChemDiv1_014392
TL;DR: ChemDiv1_014392 (CAS 389072-59-7) is a chemical compound with molecular formula C17H12BrFN4O2S2 and molecular weight 465.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: ChemDiv1_014392, 2-bromo-N-(5-((2-((2-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, F0509-1233, 2-BROMO-N-[5-({[(2-FLUOROPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]BENZAMIDE, 2-bromo-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C17H12BrFN4O2S2 |
|---|---|
| Molecular Weight | 465.96 g/mol |
| LogP | 4.4228 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.9569 |
| Heavy Atoms | 27 |
| Complexity | 982.8271 |
Chemical Identifiers
| CAS Number | 389072-59-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3F)Br |
Product Overview
ChemDiv1_014392 (CAS 389072-59-7), with molecular formula C17H12BrFN4O2S2 and molecular weight 465.96 g/mol. IUPAC: 2-bromo-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of ChemDiv1_014392
Property Insights of ChemDiv1_014392
The XLogP value of 4.4228 indicates that ChemDiv1_014392 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014392. Following Lipinski's Rule of Five, ChemDiv1_014392 has 2 hydrogen bond donor(s) and 6 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_014392?
The CAS number of ChemDiv1_014392 is 389072-59-7.
What is the molecular formula of ChemDiv1_014392?
The molecular formula of ChemDiv1_014392 is C17H12BrFN4O2S2.
What is the molecular weight of ChemDiv1_014392?
The molecular weight of ChemDiv1_014392 is 465.96 g/mol.
Where can I buy ChemDiv1_014392?
You can request a quote for ChemDiv1_014392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014392?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.