F0520-3380
TL;DR: F0520-3380 (CAS 393817-79-3) is a chemical compound with molecular formula C31H32FN5O6S2 and molecular weight 653.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[2-[[4-benzyl-5-[[(3-fluorobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: F0520-3380, diethyl 5-(2-((4-benzyl-5-((3-fluorobenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)propanamido)-3-methylthiophene-2,4-dicarboxylate, diethyl 5-[2-[[4-benzyl-5-[[(3-fluorobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-3-methylthiophene-2,4-dicarboxylate, 2,4-DIETHYL 5-{2-[(4-BENZYL-5-{[(3-FLUOROPHENYL)FORMAMIDO]METHYL}-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]PROPANAMIDO}-3-METHYLTHIOPHENE-2,4-DICARBOXYLATE
| Molecular Formula | C31H32FN5O6S2 |
|---|---|
| Molecular Weight | 653.18 g/mol |
| LogP | 5.23812 |
| Topological Polar Surface Area | 141.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 653.1778 |
| Heavy Atoms | 45 |
| Complexity | 1690.8407 |
Chemical Identifiers
| CAS Number | 393817-79-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C(C)SC2=NN=C(N2CC3=CC=CC=C3)CNC(=O)C4=CC(=CC=C4)F |
Product Overview
F0520-3380 (CAS 393817-79-3), with molecular formula C31H32FN5O6S2 and molecular weight 653.18 g/mol. IUPAC: diethyl 5-[2-[[4-benzyl-5-[[(3-fluorobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of F0520-3380
Property Insights of F0520-3380
The XLogP value of 5.23812 indicates that F0520-3380 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.51 Ų indicates high polarity, suggesting F0520-3380 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0520-3380 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0520-3380?
The CAS number of F0520-3380 is 393817-79-3.
What is the molecular formula of F0520-3380?
The molecular formula of F0520-3380 is C31H32FN5O6S2.
What is the molecular weight of F0520-3380?
The molecular weight of F0520-3380 is 653.18 g/mol.
Where can I buy F0520-3380?
You can request a quote for F0520-3380 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0520-3380?
Yes, KEHONG BIO provides custom synthesis services for F0520-3380 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.