F0520-0466
TL;DR: F0520-0466 (CAS 393849-79-1) is a chemical compound with molecular formula C32H34N6O7S2 and molecular weight 678.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[[4-(4-ethoxyphenyl)-5-[[(4-methyl-3-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F0520-0466, ethyl 2-[[2-[[4-(4-ethoxyphenyl)-5-[[(4-methyl-3-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-({[(4-(4-ethoxyphenyl)-5-{[(4-methyl-3-nitrobenzoyl)amino]methyl}-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(2-((4-(4-ethoxyphenyl)-5-((4-methyl-3-nitrobenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ETHYL 2-(2-{[4-(4-ETHOXYPHENYL)-5-{[(4-METHYL-3-NITROPHENYL)FORMAMIDO]METHYL}-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C32H34N6O7S2 |
|---|---|
| Molecular Weight | 678.19 g/mol |
| LogP | 5.66042 |
| Topological Polar Surface Area | 167.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 678.19305 |
| Heavy Atoms | 47 |
| Complexity | 1801.878 |
Chemical Identifiers
| CAS Number | 393849-79-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OCC)CNC(=O)C5=CC(=C(C=C5)C)[N+](=O)[O-] |
Product Overview
F0520-0466 (CAS 393849-79-1), with molecular formula C32H34N6O7S2 and molecular weight 678.19 g/mol. IUPAC: ethyl 2-[[2-[[4-(4-ethoxyphenyl)-5-[[(4-methyl-3-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F0520-0466
Property Insights of F0520-0466
The XLogP value of 5.66042 indicates that F0520-0466 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.58 Ų indicates high polarity, suggesting F0520-0466 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0520-0466 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 F0520-0466?
The CAS number of F0520-0466 is 393849-79-1.
What is the molecular formula of F0520-0466?
The molecular formula of F0520-0466 is C32H34N6O7S2.
What is the molecular weight of F0520-0466?
The molecular weight of F0520-0466 is 678.19 g/mol.
Where can I buy F0520-0466?
You can request a quote for F0520-0466 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0520-0466?
Yes, KEHONG BIO provides custom synthesis services for F0520-0466 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.