BAS 05260623
TL;DR: BAS 05260623 (CAS 371120-52-4) is a chemical compound with molecular formula C20H17ClN4OS2 and molecular weight 428.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-[(7-methyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]ethanone
Also Known As: BAS 05260623, 1-(4-chlorophenyl)-2-((5-methyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)ethanone, 1-(4-chlorophenyl)-2-[(5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethanone
| Molecular Formula | C20H17ClN4OS2 |
|---|---|
| Molecular Weight | 428.05 g/mol |
| LogP | 5.15462 |
| Topological Polar Surface Area | 60.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.05322 |
| Heavy Atoms | 28 |
| Complexity | 1212.873 |
Chemical Identifiers
| CAS Number | 371120-52-4 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N14)SCC(=O)C5=CC=C(C=C5)Cl |
Product Overview
BAS 05260623 (CAS 371120-52-4), with molecular formula C20H17ClN4OS2 and molecular weight 428.05 g/mol. IUPAC: 1-(4-chlorophenyl)-2-[(7-methyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]ethanone.
Chemical Property Profile of BAS 05260623
Property Insights of BAS 05260623
The XLogP value of 5.15462 indicates that BAS 05260623 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05260623. Following Lipinski's Rule of Five, BAS 05260623 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 05260623?
The CAS number of BAS 05260623 is 371120-52-4.
What is the molecular formula of BAS 05260623?
The molecular formula of BAS 05260623 is C20H17ClN4OS2.
What is the molecular weight of BAS 05260623?
The molecular weight of BAS 05260623 is 428.05 g/mol.
Where can I buy BAS 05260623?
You can request a quote for BAS 05260623 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05260623?
Yes, KEHONG BIO provides custom synthesis services for BAS 05260623 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.