F1063-0550
TL;DR: F1063-0550 (CAS 681814-98-2) is a chemical compound with molecular formula C23H20N2O7S2 and molecular weight 500.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-[4-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
Also Known As: F1063-0550, (Z)-2-hydroxy-5-(4-(5-(4-(methoxycarbonyl)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)butanamido)benzoic acid, 2-HYDROXY-5-{4-[(5Z)-5-{[4-(METHOXYCARBONYL)PHENYL]METHYLIDENE}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]BUTANAMIDO}BENZOIC ACID, 2-hydroxy-5-[4-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid, 2-hydroxy-5-[4-(5-{[4-(methoxycarbonyl)phenyl]methylene}-4-oxo-2-thioxo(1,3-th iazolidin-3-yl))butanoylamino]benzoic acid
| Molecular Formula | C23H20N2O7S2 |
|---|---|
| Molecular Weight | 500.07 g/mol |
| LogP | 3.4971 |
| Topological Polar Surface Area | 133.24 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 500.0712 |
| Heavy Atoms | 34 |
| Complexity | 1192.3048 |
Chemical Identifiers
| CAS Number | 681814-98-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)NC3=CC(=C(C=C3)O)C(=O)O |
Product Overview
F1063-0550 (CAS 681814-98-2), with molecular formula C23H20N2O7S2 and molecular weight 500.07 g/mol. IUPAC: 2-hydroxy-5-[4-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid.
Chemical Property Profile of F1063-0550
Property Insights of F1063-0550
The XLogP value of 3.4971 indicates that F1063-0550 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.24 Ų falls within the moderate polarity range, balancing permeability and solubility for F1063-0550. Following Lipinski's Rule of Five, F1063-0550 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1063-0550?
The CAS number of F1063-0550 is 681814-98-2.
What is the molecular formula of F1063-0550?
The molecular formula of F1063-0550 is C23H20N2O7S2.
What is the molecular weight of F1063-0550?
The molecular weight of F1063-0550 is 500.07 g/mol.
Where can I buy F1063-0550?
You can request a quote for F1063-0550 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1063-0550?
Yes, KEHONG BIO provides custom synthesis services for F1063-0550 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.