A2718/0115527
TL;DR: A2718/0115527 (CAS 442641-59-0) is a chemical compound with molecular formula C20H14Cl2F4N4O4S3 and molecular weight 615.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[2-[4-[chloro(difluoro)methoxy]anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[4-[chloro(difluoro)methoxy]phenyl]acetamide
Also Known As: A2718/0115527, 2-[[5-[2-[4-[chloro(difluoro)methoxy]anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[4-[chloro(difluoro)methoxy]phenyl]acetamide, 2,2'-(1,3,4-thiadiazole-2,5-diyldisulfanediyl)bis(N-{4-[chloro(difluoro)methoxy]phenyl}acetamide), 2,2'-[1,3,4-thiadiazole-2,5-diylbis(thio)]bis(N-{4-[chloro(difluoro)methoxy]phenyl}acetamide), N-[4-(CHLORODIFLUOROMETHOXY)PHENYL]-2-({5-[({[4-(CHLORODIFLUOROMETHOXY)PHENYL]CARBAMOYL}METHYL)SULFANYL]-1,3,4-THIADIAZOL-2-YL}SULFANYL)ACETAMIDE
| Molecular Formula | C20H14Cl2F4N4O4S3 |
|---|---|
| Molecular Weight | 615.95 g/mol |
| LogP | 6.3355 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 615.94904 |
| Heavy Atoms | 37 |
| Complexity | 1118.044 |
Chemical Identifiers
| CAS Number | 442641-59-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CSC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)OC(F)(F)Cl)OC(F)(F)Cl |
Product Overview
A2718/0115527 (CAS 442641-59-0), with molecular formula C20H14Cl2F4N4O4S3 and molecular weight 615.95 g/mol. IUPAC: 2-[[5-[2-[4-[chloro(difluoro)methoxy]anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[4-[chloro(difluoro)methoxy]phenyl]acetamide.
Chemical Property Profile of A2718/0115527
Property Insights of A2718/0115527
The XLogP value of 6.3355 indicates that A2718/0115527 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.44 Ų falls within the moderate polarity range, balancing permeability and solubility for A2718/0115527. Following Lipinski's Rule of Five, A2718/0115527 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2718/0115527?
The CAS number of A2718/0115527 is 442641-59-0.
What is the molecular formula of A2718/0115527?
The molecular formula of A2718/0115527 is C20H14Cl2F4N4O4S3.
What is the molecular weight of A2718/0115527?
The molecular weight of A2718/0115527 is 615.95 g/mol.
Where can I buy A2718/0115527?
You can request a quote for A2718/0115527 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2718/0115527?
Yes, KEHONG BIO provides custom synthesis services for A2718/0115527 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.