AP-970/43376949
TL;DR: AP-970/43376949 (CAS 892173-39-6) is a chemical compound with molecular formula C20H20ClN3O4S and molecular weight 433.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(butanoylamino)-2-chlorophenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: AP-970/43376949, N-[[5-(butanoylamino)-2-chlorophenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-{[5-(butanoylamino)-2-chlorophenyl]carbamothioyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-[4-chloro-3-({[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]carbothioyl}amino)phenyl]butanamide
| Molecular Formula | C20H20ClN3O4S |
|---|---|
| Molecular Weight | 433.09 g/mol |
| LogP | 3.9766 |
| Topological Polar Surface Area | 88.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.0863 |
| Heavy Atoms | 29 |
| Complexity | 951.3187 |
Chemical Identifiers
| CAS Number | 892173-39-6 |
|---|---|
| SMILES | CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C2=CC3=C(C=C2)OCCO3 |
Product Overview
AP-970/43376949 (CAS 892173-39-6), with molecular formula C20H20ClN3O4S and molecular weight 433.09 g/mol. IUPAC: N-[[5-(butanoylamino)-2-chlorophenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of AP-970/43376949
Property Insights of AP-970/43376949
The XLogP value of 3.9766 indicates that AP-970/43376949 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.69 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/43376949. Following Lipinski's Rule of Five, AP-970/43376949 has 3 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-970/43376949?
The CAS number of AP-970/43376949 is 892173-39-6.
What is the molecular formula of AP-970/43376949?
The molecular formula of AP-970/43376949 is C20H20ClN3O4S.
What is the molecular weight of AP-970/43376949?
The molecular weight of AP-970/43376949 is 433.09 g/mol.
Where can I buy AP-970/43376949?
You can request a quote for AP-970/43376949 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/43376949?
Yes, KEHONG BIO provides custom synthesis services for AP-970/43376949 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.