BAS 05290528
TL;DR: BAS 05290528 (CAS 370849-95-9) is a chemical compound with molecular formula C20H26N6O2S3 and molecular weight 478.13 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-(3-morpholin-4-ylpropyl)acetamide
Also Known As: BAS 05290528, 2-[5-(Benzothiazol-2-ylsulfanylmethyl)-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl]-N-(3-morpholin-4-yl-propyl)-acetamide, 2-((5-((benzo[d]thiazol-2-ylthio)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(3-morpholinopropyl)acetamide, 2-({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(morpholin-4-yl)propyl]acetamide, 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-morpholin-4-ylpropyl)acetamide
| Molecular Formula | C20H26N6O2S3 |
|---|---|
| Molecular Weight | 478.13 g/mol |
| LogP | 2.6477 |
| Topological Polar Surface Area | 85.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 478.12793 |
| Heavy Atoms | 31 |
| Complexity | 968.8849 |
Chemical Identifiers
| CAS Number | 370849-95-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NCCCN2CCOCC2)CSC3=NC4=CC=CC=C4S3 |
Product Overview
BAS 05290528 (CAS 370849-95-9), with molecular formula C20H26N6O2S3 and molecular weight 478.13 g/mol. IUPAC: 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-morpholin-4-ylpropyl)acetamide.
Chemical Property Profile of BAS 05290528
Property Insights of BAS 05290528
The XLogP value of 2.6477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05290528. The TPSA of 85.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05290528. Following Lipinski's Rule of Five, BAS 05290528 has 1 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 05290528?
The CAS number of BAS 05290528 is 370849-95-9.
What is the molecular formula of BAS 05290528?
The molecular formula of BAS 05290528 is C20H26N6O2S3.
What is the molecular weight of BAS 05290528?
The molecular weight of BAS 05290528 is 478.13 g/mol.
Where can I buy BAS 05290528?
You can request a quote for BAS 05290528 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05290528?
Yes, KEHONG BIO provides custom synthesis services for BAS 05290528 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.