BAS 02053214
TL;DR: BAS 02053214 (CAS 332946-63-1) is a chemical compound with molecular formula C20H18N4O2S2 and molecular weight 410.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Also Known As: BAS 02053214, 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)acetamide, 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide, N-(3-cyano(4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl))-2-[5-benzyl(1,3,4-oxadiaz ol-2-ylthio)]acetamide
| Molecular Formula | C20H18N4O2S2 |
|---|---|
| Molecular Weight | 410.09 g/mol |
| LogP | 4.20318 |
| Topological Polar Surface Area | 91.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.08713 |
| Heavy Atoms | 28 |
| Complexity | 1020.75287 |
Chemical Identifiers
| CAS Number | 332946-63-1 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NN=C(O3)CC4=CC=CC=C4)C#N |
Product Overview
BAS 02053214 (CAS 332946-63-1), with molecular formula C20H18N4O2S2 and molecular weight 410.09 g/mol. IUPAC: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide.
Chemical Property Profile of BAS 02053214
Property Insights of BAS 02053214
The XLogP value of 4.20318 indicates that BAS 02053214 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.81 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02053214. Following Lipinski's Rule of Five, BAS 02053214 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 02053214?
The CAS number of BAS 02053214 is 332946-63-1.
What is the molecular formula of BAS 02053214?
The molecular formula of BAS 02053214 is C20H18N4O2S2.
What is the molecular weight of BAS 02053214?
The molecular weight of BAS 02053214 is 410.09 g/mol.
Where can I buy BAS 02053214?
You can request a quote for BAS 02053214 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02053214?
Yes, KEHONG BIO provides custom synthesis services for BAS 02053214 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.