F2563-0185
TL;DR: F2563-0185 (CAS 896292-92-5) is a chemical compound with molecular formula C18H19N5O3S and molecular weight 385.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[2-[(5-ethyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: F2563-0185, methyl 4-[[2-[(5-ethyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate, methyl 4-(2-{[5-ethyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate, methyl 4-[({[5-ethyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate, methyl 4-(2-((5-ethyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate
| Molecular Formula | C18H19N5O3S |
|---|---|
| Molecular Weight | 385.12 g/mol |
| LogP | 2.4708 |
| Topological Polar Surface Area | 91.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.12085 |
| Heavy Atoms | 27 |
| Complexity | 919.1375 |
Chemical Identifiers
| CAS Number | 896292-92-5 |
|---|---|
| SMILES | CCC1=NN=C(N1N2C=CC=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC |
Product Overview
F2563-0185 (CAS 896292-92-5), with molecular formula C18H19N5O3S and molecular weight 385.12 g/mol. IUPAC: methyl 4-[[2-[(5-ethyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F2563-0185
Property Insights of F2563-0185
The XLogP value of 2.4708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2563-0185. The TPSA of 91.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F2563-0185. Following Lipinski's Rule of Five, F2563-0185 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 F2563-0185?
The CAS number of F2563-0185 is 896292-92-5.
What is the molecular formula of F2563-0185?
The molecular formula of F2563-0185 is C18H19N5O3S.
What is the molecular weight of F2563-0185?
The molecular weight of F2563-0185 is 385.12 g/mol.
Where can I buy F2563-0185?
You can request a quote for F2563-0185 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2563-0185?
Yes, KEHONG BIO provides custom synthesis services for F2563-0185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.