BAS 14583766
TL;DR: BAS 14583766 (CAS 879052-00-3) is a chemical compound with molecular formula C17H9N5O2S and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)chromen-2-one
Also Known As: BAS 14583766, A4089/0174309, 3-(3-(pyridin-3-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2H-chromen-2-one, 3-(3-Pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-chromen-2-one, 3-(3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)chromen-2-one
| Molecular Formula | C17H9N5O2S |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | 3.0212 |
| Topological Polar Surface Area | 86.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.0477 |
| Heavy Atoms | 25 |
| Complexity | 1272.6918 |
Chemical Identifiers
| CAS Number | 879052-00-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=NN4C(=NN=C4S3)C5=CN=CC=C5 |
Product Overview
BAS 14583766 (CAS 879052-00-3), with molecular formula C17H9N5O2S and molecular weight 347.05 g/mol. IUPAC: 3-(3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)chromen-2-one.
Chemical Property Profile of BAS 14583766
Property Insights of BAS 14583766
The XLogP value of 3.0212 indicates that BAS 14583766 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 14583766. Following Lipinski's Rule of Five, BAS 14583766 has 0 hydrogen bond donor(s) and 7 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 14583766?
The CAS number of BAS 14583766 is 879052-00-3.
What is the molecular formula of BAS 14583766?
The molecular formula of BAS 14583766 is C17H9N5O2S.
What is the molecular weight of BAS 14583766?
The molecular weight of BAS 14583766 is 347.05 g/mol.
Where can I buy BAS 14583766?
You can request a quote for BAS 14583766 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 14583766?
Yes, KEHONG BIO provides custom synthesis services for BAS 14583766 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.