AP-970/43268261
TL;DR: AP-970/43268261 (CAS 890187-21-0) is a chemical compound with molecular formula C21H24ClN3O3S and molecular weight 433.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-(4-methylpiperazin-1-yl)benzoate
Also Known As: AP-970/43268261, Methyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-(4-methylpiperazin-1-yl)benzoate, methyl 3-({[(4-chlorophenyl)sulfanyl]acetyl}amino)-4-(4-methyl-1-piperazinyl)benzoate, methyl 3-({[(4-chlorophenyl)sulfanyl]acetyl}amino)-4-(4-methylpiperazin-1-yl)benzoate, methyl 3-(2-((4-chlorophenyl)thio)acetamido)-4-(4-methylpiperazin-1-yl)benzoate
| Molecular Formula | C21H24ClN3O3S |
|---|---|
| Molecular Weight | 433.12 g/mol |
| LogP | 3.6092 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.12268 |
| Heavy Atoms | 29 |
| Complexity | 867.9751 |
Chemical Identifiers
| CAS Number | 890187-21-0 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)CSC3=CC=C(C=C3)Cl |
Product Overview
AP-970/43268261 (CAS 890187-21-0), with molecular formula C21H24ClN3O3S and molecular weight 433.12 g/mol. IUPAC: methyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-(4-methylpiperazin-1-yl)benzoate.
Chemical Property Profile of AP-970/43268261
Property Insights of AP-970/43268261
The XLogP value of 3.6092 indicates that AP-970/43268261 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/43268261. Following Lipinski's Rule of Five, AP-970/43268261 has 1 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-970/43268261?
The CAS number of AP-970/43268261 is 890187-21-0.
What is the molecular formula of AP-970/43268261?
The molecular formula of AP-970/43268261 is C21H24ClN3O3S.
What is the molecular weight of AP-970/43268261?
The molecular weight of AP-970/43268261 is 433.12 g/mol.
Where can I buy AP-970/43268261?
You can request a quote for AP-970/43268261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/43268261?
Yes, KEHONG BIO provides custom synthesis services for AP-970/43268261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.