F0520-0995
TL;DR: F0520-0995 (CAS 393804-77-8) is a chemical compound with molecular formula C32H35N5O8S2 and molecular weight 681.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[[2-[[4-(4-ethoxyphenyl)-5-[[(2-phenoxyacetyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: F0520-0995, diethyl 5-(2-((4-(4-ethoxyphenyl)-5-((2-phenoxyacetamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)-3-methylthiophene-2,4-dicarboxylate, diethyl 5-[[2-[[4-(4-ethoxyphenyl)-5-[[(2-phenoxyacetyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate, 2,4-DIETHYL 5-(2-{[4-(4-ETHOXYPHENYL)-5-[(2-PHENOXYACETAMIDO)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDO)-3-METHYLTHIOPHENE-2,4-DICARBOXYLATE
| Molecular Formula | C32H35N5O8S2 |
|---|---|
| Molecular Weight | 681.19 g/mol |
| LogP | 4.81532 |
| Topological Polar Surface Area | 159.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 16 |
| Exact Mass | 681.1927 |
| Heavy Atoms | 47 |
| Complexity | 1689.4125 |
Chemical Identifiers
| CAS Number | 393804-77-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)OCC)CNC(=O)COC4=CC=CC=C4 |
Product Overview
F0520-0995 (CAS 393804-77-8), with molecular formula C32H35N5O8S2 and molecular weight 681.19 g/mol. IUPAC: diethyl 5-[[2-[[4-(4-ethoxyphenyl)-5-[[(2-phenoxyacetyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of F0520-0995
Property Insights of F0520-0995
The XLogP value of 4.81532 indicates that F0520-0995 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.97 Ų indicates high polarity, suggesting F0520-0995 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0520-0995 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0520-0995?
The CAS number of F0520-0995 is 393804-77-8.
What is the molecular formula of F0520-0995?
The molecular formula of F0520-0995 is C32H35N5O8S2.
What is the molecular weight of F0520-0995?
The molecular weight of F0520-0995 is 681.19 g/mol.
Where can I buy F0520-0995?
You can request a quote for F0520-0995 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0520-0995?
Yes, KEHONG BIO provides custom synthesis services for F0520-0995 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.