BAS 05290769
TL;DR: BAS 05290769 (CAS 433701-29-2) is a chemical compound with molecular formula C17H21N5O3S3 and molecular weight 439.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-hydroxyethoxy)ethyl]acetamide
Also Known As: BAS 05290769, 2-[5-(benzothiazol-2-ylthiomethyl)-4-methyl(1,2,4-triazol-3-ylthio)]-N-[2-(2-h ydroxyethoxy)ethyl]acetamide, 2-((5-((benzo[d]thiazol-2-ylthio)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(2-(2-hydroxyethoxy)ethyl)acetamide, 2-({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(2-hydroxyethoxy)ethyl]acetamide, 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-hydroxyethoxy)ethyl]acetamide
| Molecular Formula | C17H21N5O3S3 |
|---|---|
| Molecular Weight | 439.08 g/mol |
| LogP | 1.9343 |
| Topological Polar Surface Area | 102.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 439.08066 |
| Heavy Atoms | 28 |
| Complexity | 881.47015 |
Chemical Identifiers
| CAS Number | 433701-29-2 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NCCOCCO)CSC2=NC3=CC=CC=C3S2 |
Product Overview
BAS 05290769 (CAS 433701-29-2), with molecular formula C17H21N5O3S3 and molecular weight 439.08 g/mol. IUPAC: 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-hydroxyethoxy)ethyl]acetamide.
Chemical Property Profile of BAS 05290769
Property Insights of BAS 05290769
The XLogP value of 1.9343 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05290769. The TPSA of 102.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05290769. Following Lipinski's Rule of Five, BAS 05290769 has 2 hydrogen bond donor(s) and 9 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 05290769?
The CAS number of BAS 05290769 is 433701-29-2.
What is the molecular formula of BAS 05290769?
The molecular formula of BAS 05290769 is C17H21N5O3S3.
What is the molecular weight of BAS 05290769?
The molecular weight of BAS 05290769 is 439.08 g/mol.
Where can I buy BAS 05290769?
You can request a quote for BAS 05290769 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05290769?
Yes, KEHONG BIO provides custom synthesis services for BAS 05290769 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.