F2563-0186
TL;DR: F2563-0186 (CAS 896293-00-8) is a chemical compound with molecular formula C19H21N5O3S and molecular weight 399.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(5-ethyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: F2563-0186, ethyl 2-(2-{[5-ethyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate, ethyl 2-(2-((5-ethyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate, ethyl 2-[[2-[(5-ethyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C19H21N5O3S |
|---|---|
| Molecular Weight | 399.14 g/mol |
| LogP | 2.8609 |
| Topological Polar Surface Area | 91.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.1365 |
| Heavy Atoms | 28 |
| Complexity | 952.39716 |
Chemical Identifiers
| CAS Number | 896293-00-8 |
|---|---|
| SMILES | CCC1=NN=C(N1N2C=CC=C2)SCC(=O)NC3=CC=CC=C3C(=O)OCC |
Product Overview
F2563-0186 (CAS 896293-00-8), with molecular formula C19H21N5O3S and molecular weight 399.14 g/mol. IUPAC: ethyl 2-[[2-[(5-ethyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F2563-0186
Property Insights of F2563-0186
The XLogP value of 2.8609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2563-0186. The TPSA of 91.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F2563-0186. Following Lipinski's Rule of Five, F2563-0186 has 1 hydrogen bond donor(s) and 6 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 F2563-0186?
The CAS number of F2563-0186 is 896293-00-8.
What is the molecular formula of F2563-0186?
The molecular formula of F2563-0186 is C19H21N5O3S.
What is the molecular weight of F2563-0186?
The molecular weight of F2563-0186 is 399.14 g/mol.
Where can I buy F2563-0186?
You can request a quote for F2563-0186 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2563-0186?
Yes, KEHONG BIO provides custom synthesis services for F2563-0186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.