AO-022/43454702
TL;DR: AO-022/43454702 (CAS 825655-89-8) is a chemical compound with molecular formula C16H17BrN4O3S and molecular weight 424.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetyl-5'-bromo-2'-oxo-1'-propylspiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide
Also Known As: AO-022/43454702, N-(4-acetyl-5'-bromo-2'-oxo-1'-propylspiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide, N-(3'-acetyl-5-bromo-2-oxo-1-propyl-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl)acetamide, N-(3'-acetyl-5-bromo-2-oxo-1-propyl-3'H-spiro[indoline-3,2'-[1,3,4]thiadiazol]-5'-yl)acetamide, N-{3'-ACETYL-5-BROMO-2-OXO-1-PROPYL-1,2-DIHYDRO-3'H-SPIRO[INDOLE-3,2'-[1,3,4]THIADIAZOL]-5'-YL}ACETAMIDE
| Molecular Formula | C16H17BrN4O3S |
|---|---|
| Molecular Weight | 424.02 g/mol |
| LogP | 2.3609 |
| Topological Polar Surface Area | 82.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 424.02048 |
| Heavy Atoms | 25 |
| Complexity | 812.5696 |
Chemical Identifiers
| CAS Number | 825655-89-8 |
|---|---|
| SMILES | CCCN1C2=C(C=C(C=C2)Br)C3(C1=O)N(N=C(S3)NC(=O)C)C(=O)C |
Product Overview
AO-022/43454702 (CAS 825655-89-8), with molecular formula C16H17BrN4O3S and molecular weight 424.02 g/mol. IUPAC: N-(4-acetyl-5'-bromo-2'-oxo-1'-propylspiro[1,3,4-thiadiazole-5,3'-indole]-2-yl)acetamide.
Chemical Property Profile of AO-022/43454702
Property Insights of AO-022/43454702
The XLogP value of 2.3609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/43454702. The TPSA of 82.08 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454702. Following Lipinski's Rule of Five, AO-022/43454702 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-022/43454702?
The CAS number of AO-022/43454702 is 825655-89-8.
What is the molecular formula of AO-022/43454702?
The molecular formula of AO-022/43454702 is C16H17BrN4O3S.
What is the molecular weight of AO-022/43454702?
The molecular weight of AO-022/43454702 is 424.02 g/mol.
Where can I buy AO-022/43454702?
You can request a quote for AO-022/43454702 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454702?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454702 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.