BAS 04210717
TL;DR: BAS 04210717 (CAS 498551-08-9) is a chemical compound with molecular formula C16H13N5O2S2 and molecular weight 371.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 04210717, N-(1,3-benzothiazol-2-yl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(1,3-benzothiazol-2-yl)-2-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C16H13N5O2S2 |
|---|---|
| Molecular Weight | 371.05 g/mol |
| LogP | 3.4156 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.05106 |
| Heavy Atoms | 25 |
| Complexity | 989.448 |
Chemical Identifiers
| CAS Number | 498551-08-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)C4=CC=CO4 |
Product Overview
BAS 04210717 (CAS 498551-08-9), with molecular formula C16H13N5O2S2 and molecular weight 371.05 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 04210717
Property Insights of BAS 04210717
The XLogP value of 3.4156 indicates that BAS 04210717 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04210717. Following Lipinski's Rule of Five, BAS 04210717 has 1 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 04210717?
The CAS number of BAS 04210717 is 498551-08-9.
What is the molecular formula of BAS 04210717?
The molecular formula of BAS 04210717 is C16H13N5O2S2.
What is the molecular weight of BAS 04210717?
The molecular weight of BAS 04210717 is 371.05 g/mol.
Where can I buy BAS 04210717?
You can request a quote for BAS 04210717 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04210717?
Yes, KEHONG BIO provides custom synthesis services for BAS 04210717 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.