AP-970/42776571
TL;DR: AP-970/42776571 (CAS 709004-75-1) is a chemical compound with molecular formula C24H34N4O3S2 and molecular weight 490.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-N-[[4-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]acetamide
Also Known As: AP-970/42776571, 2-(1-adamantyl)-N-[[4-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]acetamide, N-(1-adamantylacetyl)-N'-{4-[4-(methylsulfonyl)-1-piperazinyl]phenyl}thiourea, N-({4-[4-(methylsulfonyl)piperazin-1-yl]phenyl}carbamothioyl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide, 2-(1-adamantyl)-N-[[4-(4-methylsulfonylpiperazin-1-yl)phenyl]thiocarbamoyl]acetamide
| Molecular Formula | C24H34N4O3S2 |
|---|---|
| Molecular Weight | 490.21 g/mol |
| LogP | 3.1877 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 490.20724 |
| Heavy Atoms | 33 |
| Complexity | 981.36566 |
Chemical Identifiers
| CAS Number | 709004-75-1 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CC34CC5CC(C3)CC(C5)C4 |
Product Overview
AP-970/42776571 (CAS 709004-75-1), with molecular formula C24H34N4O3S2 and molecular weight 490.21 g/mol. IUPAC: 2-(1-adamantyl)-N-[[4-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]acetamide.
Chemical Property Profile of AP-970/42776571
Property Insights of AP-970/42776571
The XLogP value of 3.1877 indicates that AP-970/42776571 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.75 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42776571. Following Lipinski's Rule of Five, AP-970/42776571 has 2 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 AP-970/42776571?
The CAS number of AP-970/42776571 is 709004-75-1.
What is the molecular formula of AP-970/42776571?
The molecular formula of AP-970/42776571 is C24H34N4O3S2.
What is the molecular weight of AP-970/42776571?
The molecular weight of AP-970/42776571 is 490.21 g/mol.
Where can I buy AP-970/42776571?
You can request a quote for AP-970/42776571 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42776571?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42776571 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.