1-FTI
TL;DR: 1-FTI (CAS 145724-06-7) is a chemical compound with molecular formula C37H37N3O6S2 and molecular weight 683.2124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzyl-N-[6-[(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)carbamothioylamino]hexyl]-3-sulfanylpropanamide
Also Known As: 1-FTI, N-(Fluoresceinyl)-N'-(1-(6-(3-mercapto-2-benzyl-1-oxopropyl)amino)-1-hexyl)thiocarbamide, 2-benzyl-N-[6-[(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)carbamothioylamino]hexyl]-3-sulfanylpropanamide, 2-Benzyl-N-[6-({[(3',6'-dihydroxy-3-oxo-3H-spiro[[2]benzofuran-1,9'-xanthen]-5-yl)amino](sulfanyl)methylidene}amino)hexyl]-3-sulfanylpropanimidic acid, 2-Benzyl-N-[6-({[(3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl)amino](sulfanyl)methylidene}amino)hexyl]-3-sulfanylpropanimidic acid
Technical Specifications
| Molecular Formula | C37H37N3O6S2 |
| Molecular Weight | 683.2124 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 162.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 683.2124 Da |
| Heavy Atoms | 48 |
| Complexity | 1080.0 |
| SMILES | C1=CC=C(C=C1)CC(CS)C(=O)NCCCCCCNC(=S)NC2=CC3=C(C=C2)C4(C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O)OC3=O |
| InChIKey | BWMAQIUFALCFIM-UHFFFAOYSA-N |
Chemical Property Profile of 1-FTI
Property Insights of 1-FTI
The XLogP value of 6.0 indicates that 1-FTI is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.0 Ų indicates high polarity, suggesting 1-FTI may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-FTI has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-FTI?
The CAS number of 1-FTI is 145724-06-7.
What is the molecular formula of 1-FTI?
The molecular formula of 1-FTI is C37H37N3O6S2.
What is the molecular weight of 1-FTI?
The molecular weight of 1-FTI is 683.2124 g/mol.
Where can I buy 1-FTI?
You can request a quote for 1-FTI directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-FTI?
Yes, CoreyChem provides custom synthesis services for 1-FTI and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.