BAS 05384159
TL;DR: BAS 05384159 (CAS 487020-10-0) is a chemical compound with molecular formula C21H21N5OS2 and molecular weight 423.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-ethyl-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]-N-phenylacetamide
Also Known As: BAS 05384159, 2-((5-ethyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-N-phenylacetamide, 2-[(5-ethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-N-phenylacetamide
| Molecular Formula | C21H21N5OS2 |
|---|---|
| Molecular Weight | 423.12 g/mol |
| LogP | 4.511 |
| Topological Polar Surface Area | 72.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.11874 |
| Heavy Atoms | 29 |
| Complexity | 1198.4535 |
Chemical Identifiers
| CAS Number | 487020-10-0 |
|---|---|
| SMILES | CCC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N14)SCC(=O)NC5=CC=CC=C5 |
Product Overview
BAS 05384159 (CAS 487020-10-0), with molecular formula C21H21N5OS2 and molecular weight 423.12 g/mol. IUPAC: 2-[(7-ethyl-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]-N-phenylacetamide.
Chemical Property Profile of BAS 05384159
Property Insights of BAS 05384159
The XLogP value of 4.511 indicates that BAS 05384159 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05384159. Following Lipinski's Rule of Five, BAS 05384159 has 1 hydrogen bond donor(s) and 6 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 05384159?
The CAS number of BAS 05384159 is 487020-10-0.
What is the molecular formula of BAS 05384159?
The molecular formula of BAS 05384159 is C21H21N5OS2.
What is the molecular weight of BAS 05384159?
The molecular weight of BAS 05384159 is 423.12 g/mol.
Where can I buy BAS 05384159?
You can request a quote for BAS 05384159 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05384159?
Yes, KEHONG BIO provides custom synthesis services for BAS 05384159 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.