AP-970/42153858
TL;DR: AP-970/42153858 (CAS 642419-83-8) is a chemical compound with molecular formula C28H26N4O3S and molecular weight 498.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: AP-970/42153858, N-[[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]carbamothioyl]-1-benzofuran-2-carboxamide, N-[(4-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-1-benzofuran-2-carboxamide, N-(1-benzofuran-2-ylcarbonyl)-N'-{4-[4-(4-methylbenzoyl)-1-piperazinyl]phenyl}thiourea, N-(1-BENZOFURAN-2-YLCARBONYL)-N'-{4-[4-(4-METHYLBENZOYL)PIPERAZINO]PHENYL}THIOUREA
| Molecular Formula | C28H26N4O3S |
|---|---|
| Molecular Weight | 498.17 g/mol |
| LogP | 4.83042 |
| Topological Polar Surface Area | 77.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 498.17258 |
| Heavy Atoms | 36 |
| Complexity | 1372.0261 |
Chemical Identifiers
| CAS Number | 642419-83-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4 |
Product Overview
AP-970/42153858 (CAS 642419-83-8), with molecular formula C28H26N4O3S and molecular weight 498.17 g/mol. IUPAC: N-[[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of AP-970/42153858
Property Insights of AP-970/42153858
The XLogP value of 4.83042 indicates that AP-970/42153858 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.82 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42153858. Following Lipinski's Rule of Five, AP-970/42153858 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-970/42153858?
The CAS number of AP-970/42153858 is 642419-83-8.
What is the molecular formula of AP-970/42153858?
The molecular formula of AP-970/42153858 is C28H26N4O3S.
What is the molecular weight of AP-970/42153858?
The molecular weight of AP-970/42153858 is 498.17 g/mol.
Where can I buy AP-970/42153858?
You can request a quote for AP-970/42153858 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42153858?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42153858 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.