F0721-0893
TL;DR: F0721-0893 (CAS 310427-54-4) is a chemical compound with molecular formula C31H31FN6O7S2 and molecular weight 682.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[4-(4-fluorophenyl)-5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F0721-0893, ethyl 4-(2-{[4-(4-fluorophenyl)-5-({[4-(morpholine-4-sulfonyl)phenyl]formamido}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate, ethyl 4-(2-((4-(4-fluorophenyl)-5-((4-(morpholinosulfonyl)benzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate, ethyl 4-[[2-[[4-(4-fluorophenyl)-5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C31H31FN6O7S2 |
|---|---|
| Molecular Weight | 682.17 g/mol |
| LogP | 3.2648 |
| Topological Polar Surface Area | 161.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 682.16797 |
| Heavy Atoms | 47 |
| Complexity | 1827.5728 |
Chemical Identifiers
| CAS Number | 310427-54-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5 |
Product Overview
F0721-0893 (CAS 310427-54-4), with molecular formula C31H31FN6O7S2 and molecular weight 682.17 g/mol. IUPAC: ethyl 4-[[2-[[4-(4-fluorophenyl)-5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F0721-0893
Property Insights of F0721-0893
The XLogP value of 3.2648 indicates that F0721-0893 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 161.82 Ų indicates high polarity, suggesting F0721-0893 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0721-0893 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 F0721-0893?
The CAS number of F0721-0893 is 310427-54-4.
What is the molecular formula of F0721-0893?
The molecular formula of F0721-0893 is C31H31FN6O7S2.
What is the molecular weight of F0721-0893?
The molecular weight of F0721-0893 is 682.17 g/mol.
Where can I buy F0721-0893?
You can request a quote for F0721-0893 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0893?
Yes, KEHONG BIO provides custom synthesis services for F0721-0893 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.