F0509-2998
TL;DR: F0509-2998 (CAS 393569-44-3) is a chemical compound with molecular formula C21H17BrN6O4S3 and molecular weight 591.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,3-dimethoxybenzamide
Also Known As: F0509-2998, N-(5-((2-((5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2,3-dimethoxybenzamide, N-[5-[2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,3-dimethoxybenzamide
| Molecular Formula | C21H17BrN6O4S3 |
|---|---|
| Molecular Weight | 591.97 g/mol |
| LogP | 4.8194 |
| Topological Polar Surface Area | 128.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 591.9657 |
| Heavy Atoms | 35 |
| Complexity | 1345.0957 |
Chemical Identifiers
| CAS Number | 393569-44-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C(=O)NC2=NN=C(S2)SCC(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br |
Product Overview
F0509-2998 (CAS 393569-44-3), with molecular formula C21H17BrN6O4S3 and molecular weight 591.97 g/mol. IUPAC: N-[5-[2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,3-dimethoxybenzamide.
Chemical Property Profile of F0509-2998
Property Insights of F0509-2998
The XLogP value of 4.8194 indicates that F0509-2998 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.22 Ų falls within the moderate polarity range, balancing permeability and solubility for F0509-2998. Following Lipinski's Rule of Five, F0509-2998 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0509-2998?
The CAS number of F0509-2998 is 393569-44-3.
What is the molecular formula of F0509-2998?
The molecular formula of F0509-2998 is C21H17BrN6O4S3.
What is the molecular weight of F0509-2998?
The molecular weight of F0509-2998 is 591.97 g/mol.
Where can I buy F0509-2998?
You can request a quote for F0509-2998 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0509-2998?
Yes, KEHONG BIO provides custom synthesis services for F0509-2998 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.