AP-970/42251110
TL;DR: AP-970/42251110 (CAS 701228-82-2) is a chemical compound with molecular formula C21H25N3O5S and molecular weight 431.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethoxy-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide
Also Known As: AP-970/42251110, 2,6-dimethoxy-N-({3-methoxy-4-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)benzamide, 2,6-dimethoxy-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide, 2,6-dimethoxy-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]thiocarbamoyl]benzamide, N-[4-({[(2,6-dimethoxybenzoyl)amino]carbothioyl}amino)-2-methoxyphenyl]-2-methylpropanamide
| Molecular Formula | C21H25N3O5S |
|---|---|
| Molecular Weight | 431.15 g/mol |
| LogP | 3.4337 |
| Topological Polar Surface Area | 97.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.1515 |
| Heavy Atoms | 30 |
| Complexity | 923.98425 |
Chemical Identifiers
| CAS Number | 701228-82-2 |
|---|---|
| SMILES | CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC)OC |
Product Overview
AP-970/42251110 (CAS 701228-82-2), with molecular formula C21H25N3O5S and molecular weight 431.15 g/mol. IUPAC: 2,6-dimethoxy-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of AP-970/42251110
Property Insights of AP-970/42251110
The XLogP value of 3.4337 indicates that AP-970/42251110 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.92 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42251110. Following Lipinski's Rule of Five, AP-970/42251110 has 3 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 AP-970/42251110?
The CAS number of AP-970/42251110 is 701228-82-2.
What is the molecular formula of AP-970/42251110?
The molecular formula of AP-970/42251110 is C21H25N3O5S.
What is the molecular weight of AP-970/42251110?
The molecular weight of AP-970/42251110 is 431.15 g/mol.
Where can I buy AP-970/42251110?
You can request a quote for AP-970/42251110 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42251110?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42251110 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.