F0772-2442
TL;DR: F0772-2442 (CAS 310449-91-3) is a chemical compound with molecular formula C25H22FN5O5S and molecular weight 523.13 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-[(furan-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F0772-2442, ethyl 4-(2-((4-(4-fluorophenyl)-5-((furan-2-carboxamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate, ethyl 4-(2-{[4-(4-fluorophenyl)-5-{[(furan-2-yl)formamido]methyl}-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate, ethyl 4-[[2-[[4-(4-fluorophenyl)-5-[(furan-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate, ethyl p-({[4-(p-fluorophenyl)-5-[(2-furylamino)methyl]-4H-1,2,4-triazol-3-ylthio]methyl}carbonylamino)benzoate
| Molecular Formula | C25H22FN5O5S |
|---|---|
| Molecular Weight | 523.13 g/mol |
| LogP | 3.8369 |
| Topological Polar Surface Area | 128.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 523.13257 |
| Heavy Atoms | 37 |
| Complexity | 1371.7405 |
Chemical Identifiers
| CAS Number | 310449-91-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)CNC(=O)C4=CC=CO4 |
Product Overview
F0772-2442 (CAS 310449-91-3), with molecular formula C25H22FN5O5S and molecular weight 523.13 g/mol. IUPAC: ethyl 4-[[2-[[4-(4-fluorophenyl)-5-[(furan-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F0772-2442
Property Insights of F0772-2442
The XLogP value of 3.8369 indicates that F0772-2442 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.35 Ų falls within the moderate polarity range, balancing permeability and solubility for F0772-2442. Following Lipinski's Rule of Five, F0772-2442 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0772-2442?
The CAS number of F0772-2442 is 310449-91-3.
What is the molecular formula of F0772-2442?
The molecular formula of F0772-2442 is C25H22FN5O5S.
What is the molecular weight of F0772-2442?
The molecular weight of F0772-2442 is 523.13 g/mol.
Where can I buy F0772-2442?
You can request a quote for F0772-2442 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0772-2442?
Yes, KEHONG BIO provides custom synthesis services for F0772-2442 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.