AP-970/42769211
TL;DR: AP-970/42769211 (CAS 708995-99-7) is a chemical compound with molecular formula C20H24N4O3S and molecular weight 400.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamothioyl]furan-2-carboxamide
Also Known As: AP-970/42769211, N-(2-furoyl)-N'-[2-(4-isobutyryl-1-piperazinyl)phenyl]thiourea, N-[[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamothioyl]furan-2-carboxamide, N-({2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl}carbamothioyl)furan-2-carboxamide
| Molecular Formula | C20H24N4O3S |
|---|---|
| Molecular Weight | 400.16 g/mol |
| LogP | 2.711 |
| Topological Polar Surface Area | 77.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.15692 |
| Heavy Atoms | 28 |
| Complexity | 842.8955 |
Chemical Identifiers
| CAS Number | 708995-99-7 |
|---|---|
| SMILES | CC(C)C(=O)N1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CO3 |
Product Overview
AP-970/42769211 (CAS 708995-99-7), with molecular formula C20H24N4O3S and molecular weight 400.16 g/mol. IUPAC: N-[[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of AP-970/42769211
Property Insights of AP-970/42769211
The XLogP value of 2.711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-970/42769211. The TPSA of 77.82 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42769211. Following Lipinski's Rule of Five, AP-970/42769211 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-970/42769211?
The CAS number of AP-970/42769211 is 708995-99-7.
What is the molecular formula of AP-970/42769211?
The molecular formula of AP-970/42769211 is C20H24N4O3S.
What is the molecular weight of AP-970/42769211?
The molecular weight of AP-970/42769211 is 400.16 g/mol.
Where can I buy AP-970/42769211?
You can request a quote for AP-970/42769211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42769211?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42769211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.