F2649-0164
TL;DR: F2649-0164 (CAS 905780-68-9) is a chemical compound with molecular formula C17H17N5O4S and molecular weight 387.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F2649-0164, ethyl 4-(2-{[4-amino-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate, ethyl 4-[[2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate, ethyl 4-[({[4-amino-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate, ethyl 4-(2-((4-amino-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate
| Molecular Formula | C17H17N5O4S |
|---|---|
| Molecular Weight | 387.10 g/mol |
| LogP | 2.1594 |
| Topological Polar Surface Area | 125.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.10013 |
| Heavy Atoms | 27 |
| Complexity | 921.4642 |
Chemical Identifiers
| CAS Number | 905780-68-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC=CO3 |
Product Overview
F2649-0164 (CAS 905780-68-9), with molecular formula C17H17N5O4S and molecular weight 387.10 g/mol. IUPAC: ethyl 4-[[2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F2649-0164
Property Insights of F2649-0164
The XLogP value of 2.1594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2649-0164. The TPSA of 125.27 Ų falls within the moderate polarity range, balancing permeability and solubility for F2649-0164. Following Lipinski's Rule of Five, F2649-0164 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F2649-0164?
The CAS number of F2649-0164 is 905780-68-9.
What is the molecular formula of F2649-0164?
The molecular formula of F2649-0164 is C17H17N5O4S.
What is the molecular weight of F2649-0164?
The molecular weight of F2649-0164 is 387.10 g/mol.
Where can I buy F2649-0164?
You can request a quote for F2649-0164 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2649-0164?
Yes, KEHONG BIO provides custom synthesis services for F2649-0164 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.