AO-022/43455280
TL;DR: AO-022/43455280 (CAS 696603-08-4) is a chemical compound with molecular formula C15H15BrN4O3S and molecular weight 410.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetyl-5'-bromo-1'-ethyl-2'-oxospiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide
Also Known As: AO-022/43455280, A3563/0151159, N-(4-acetyl-5'-bromo-1'-ethyl-2'-oxospiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide, N-(3'-acetyl-5-bromo-1-ethyl-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl)acetamide, N-(3'-acetyl-5-bromo-1-ethyl-2-oxo-3'H-spiro[indoline-3,2'-[1,3,4]thiadiazol]-5'-yl)acetamide
| Molecular Formula | C15H15BrN4O3S |
|---|---|
| Molecular Weight | 410.00 g/mol |
| LogP | 1.9708 |
| Topological Polar Surface Area | 82.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 410.00482 |
| Heavy Atoms | 24 |
| Complexity | 796.9239 |
Chemical Identifiers
| CAS Number | 696603-08-4 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)Br)C3(C1=O)N(N=C(S3)NC(=O)C)C(=O)C |
Product Overview
AO-022/43455280 (CAS 696603-08-4), with molecular formula C15H15BrN4O3S and molecular weight 410.00 g/mol. IUPAC: N-(4-acetyl-5'-bromo-1'-ethyl-2'-oxospiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide.
Chemical Property Profile of AO-022/43455280
Property Insights of AO-022/43455280
The XLogP value of 1.9708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/43455280. The TPSA of 82.08 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43455280. Following Lipinski's Rule of Five, AO-022/43455280 has 1 hydrogen bond donor(s) and 5 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 AO-022/43455280?
The CAS number of AO-022/43455280 is 696603-08-4.
What is the molecular formula of AO-022/43455280?
The molecular formula of AO-022/43455280 is C15H15BrN4O3S.
What is the molecular weight of AO-022/43455280?
The molecular weight of AO-022/43455280 is 410.00 g/mol.
Where can I buy AO-022/43455280?
You can request a quote for AO-022/43455280 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43455280?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43455280 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.