AB00680480-01
TL;DR: AB00680480-01 (CAS 886935-88-2) is a chemical compound with molecular formula C20H19N5O3S and molecular weight 409.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethoxyphenyl)-2-[[5-(furan-2-yl)-4-pyrrol-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AB00680480-01, F2650-0153, N-(2-ethoxyphenyl)-2-{[5-(furan-2-yl)-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-ethoxyphenyl)-2-[[5-(furan-2-yl)-4-pyrrol-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2-ethoxyphenyl)-2-((5-(furan-2-yl)-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C20H19N5O3S |
|---|---|
| Molecular Weight | 409.12 g/mol |
| LogP | 3.7805 |
| Topological Polar Surface Area | 87.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 409.12085 |
| Heavy Atoms | 29 |
| Complexity | 1073.7024 |
Chemical Identifiers
| CAS Number | 886935-88-2 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2N3C=CC=C3)C4=CC=CO4 |
Product Overview
AB00680480-01 (CAS 886935-88-2), with molecular formula C20H19N5O3S and molecular weight 409.12 g/mol. IUPAC: N-(2-ethoxyphenyl)-2-[[5-(furan-2-yl)-4-pyrrol-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00680480-01
Property Insights of AB00680480-01
The XLogP value of 3.7805 indicates that AB00680480-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.11 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00680480-01. Following Lipinski's Rule of Five, AB00680480-01 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 AB00680480-01?
The CAS number of AB00680480-01 is 886935-88-2.
What is the molecular formula of AB00680480-01?
The molecular formula of AB00680480-01 is C20H19N5O3S.
What is the molecular weight of AB00680480-01?
The molecular weight of AB00680480-01 is 409.12 g/mol.
Where can I buy AB00680480-01?
You can request a quote for AB00680480-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00680480-01?
Yes, KEHONG BIO provides custom synthesis services for AB00680480-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.