ChemDiv1_014176
TL;DR: ChemDiv1_014176 (CAS 389072-98-4) is a chemical compound with molecular formula C19H16ClFN4O3S2 and molecular weight 466.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide
Also Known As: ChemDiv1_014176, F0509-2782, 2-chloro-N-(5-((2-((4-ethoxyphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-6-fluorobenzamide, 2-chloro-N-[5-({[(4-ethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide, 2-chloro-N-[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide
| Molecular Formula | C19H16ClFN4O3S2 |
|---|---|
| Molecular Weight | 466.03 g/mol |
| LogP | 4.7124 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.03363 |
| Heavy Atoms | 30 |
| Complexity | 1026.2637 |
Chemical Identifiers
| CAS Number | 389072-98-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=C(C=CC=C3Cl)F |
Product Overview
ChemDiv1_014176 (CAS 389072-98-4), with molecular formula C19H16ClFN4O3S2 and molecular weight 466.03 g/mol. IUPAC: 2-chloro-N-[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide.
Chemical Property Profile of ChemDiv1_014176
Property Insights of ChemDiv1_014176
The XLogP value of 4.7124 indicates that ChemDiv1_014176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014176. Following Lipinski's Rule of Five, ChemDiv1_014176 has 2 hydrogen bond donor(s) and 7 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_014176?
The CAS number of ChemDiv1_014176 is 389072-98-4.
What is the molecular formula of ChemDiv1_014176?
The molecular formula of ChemDiv1_014176 is C19H16ClFN4O3S2.
What is the molecular weight of ChemDiv1_014176?
The molecular weight of ChemDiv1_014176 is 466.03 g/mol.
Where can I buy ChemDiv1_014176?
You can request a quote for ChemDiv1_014176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014176?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.