F0509-0956
TL;DR: F0509-0956 (CAS 389072-51-9) is a chemical compound with molecular formula C20H13Cl2N7O5S3 and molecular weight 596.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dichlorophenoxy)-N-[5-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: F0509-0956, 2-(2,4-dichlorophenoxy)-N-(5-((2-((5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)acetamide, 2-(2,4-dichlorophenoxy)-N-{5-[({[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide, 2-(2,4-dichlorophenoxy)-N-[5-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide, N-(5-{[N-5-(m-nitrophenyl)-1,3,4-thiadiazol-2-ylcarbamoyl]methylthio}-1,3,4-thiadiazol-2-yl)(2,4-dichlorophenoxy)acetamide
| Molecular Formula | C20H13Cl2N7O5S3 |
|---|---|
| Molecular Weight | 596.95 g/mol |
| LogP | 5.0199 |
| Topological Polar Surface Area | 162.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 596.9517 |
| Heavy Atoms | 37 |
| Complexity | 1465.6235 |
Chemical Identifiers
| CAS Number | 389072-51-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(S2)NC(=O)CSC3=NN=C(S3)NC(=O)COC4=C(C=C(C=C4)Cl)Cl |
Product Overview
F0509-0956 (CAS 389072-51-9), with molecular formula C20H13Cl2N7O5S3 and molecular weight 596.95 g/mol. IUPAC: 2-(2,4-dichlorophenoxy)-N-[5-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of F0509-0956
Property Insights of F0509-0956
The XLogP value of 5.0199 indicates that F0509-0956 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.13 Ų indicates high polarity, suggesting F0509-0956 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0509-0956 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0509-0956?
The CAS number of F0509-0956 is 389072-51-9.
What is the molecular formula of F0509-0956?
The molecular formula of F0509-0956 is C20H13Cl2N7O5S3.
What is the molecular weight of F0509-0956?
The molecular weight of F0509-0956 is 596.95 g/mol.
Where can I buy F0509-0956?
You can request a quote for F0509-0956 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0509-0956?
Yes, KEHONG BIO provides custom synthesis services for F0509-0956 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.