BAS 02171126
TL;DR: BAS 02171126 (CAS 73511-70-3) is a chemical compound with molecular formula C20H16N4O3S and molecular weight 392.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-phenyl-5-(quinolin-8-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
Also Known As: BAS 02171126, ({4-phenyl-5-[(quinolin-8-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetic acid, F1227-0069, 2-[4-phenyl-5-(8-quinolyloxymethyl)-1,2,4-triazol-3-ylthio]acetic acid, ({4-phenyl-5-[(8-quinolinyloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetic acid
| Molecular Formula | C20H16N4O3S |
|---|---|
| Molecular Weight | 392.09 g/mol |
| LogP | 3.5712 |
| Topological Polar Surface Area | 90.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.0943 |
| Heavy Atoms | 28 |
| Complexity | 1109.6068 |
Chemical Identifiers
| CAS Number | 73511-70-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)COC3=CC=CC4=C3N=CC=C4 |
Product Overview
BAS 02171126 (CAS 73511-70-3), with molecular formula C20H16N4O3S and molecular weight 392.09 g/mol. IUPAC: 2-[[4-phenyl-5-(quinolin-8-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid.
Chemical Property Profile of BAS 02171126
Property Insights of BAS 02171126
The XLogP value of 3.5712 indicates that BAS 02171126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.13 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02171126. Following Lipinski's Rule of Five, BAS 02171126 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 BAS 02171126?
The CAS number of BAS 02171126 is 73511-70-3.
What is the molecular formula of BAS 02171126?
The molecular formula of BAS 02171126 is C20H16N4O3S.
What is the molecular weight of BAS 02171126?
The molecular weight of BAS 02171126 is 392.09 g/mol.
Where can I buy BAS 02171126?
You can request a quote for BAS 02171126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02171126?
Yes, KEHONG BIO provides custom synthesis services for BAS 02171126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.