AE-848/32013003
TL;DR: AE-848/32013003 (CAS 300669-72-1) is a chemical compound with molecular formula C28H25N3O2S2 and molecular weight 499.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-1-(1,3-benzothiazol-2-ylsulfanyl)-3-oxo-1-phenyl-3-piperidin-1-ylprop-1-en-2-yl]benzamide
Also Known As: AE-848/32013003, N-[(Z)-1-(1,3-benzothiazol-2-ylsulfanyl)-3-oxo-1-phenyl-3-piperidin-1-ylprop-1-en-2-yl]benzamide, N-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-phenyl-1-(1-piperidinylcarbonyl)vinyl]benzamide, (Z)-N-(1-(benzo[d]thiazol-2-ylthio)-3-oxo-1-phenyl-3-(piperidin-1-yl)prop-1-en-2-yl)benzamide, N-[(1Z)-1-(1,3-benzothiazol-2-ylsulfanyl)-3-oxo-1-phenyl-3-(piperidin-1-yl)prop-1-en-2-yl]benzamide
| Molecular Formula | C28H25N3O2S2 |
|---|---|
| Molecular Weight | 499.14 g/mol |
| LogP | 6.1997 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 499.13882 |
| Heavy Atoms | 35 |
| Complexity | 1327.7583 |
Chemical Identifiers
| CAS Number | 300669-72-1 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)/C(=C(\C2=CC=CC=C2)/SC3=NC4=CC=CC=C4S3)/NC(=O)C5=CC=CC=C5 |
Product Overview
AE-848/32013003 (CAS 300669-72-1), with molecular formula C28H25N3O2S2 and molecular weight 499.14 g/mol. IUPAC: N-[(Z)-1-(1,3-benzothiazol-2-ylsulfanyl)-3-oxo-1-phenyl-3-piperidin-1-ylprop-1-en-2-yl]benzamide.
Chemical Property Profile of AE-848/32013003
Property Insights of AE-848/32013003
The XLogP value of 6.1997 indicates that AE-848/32013003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/32013003. Following Lipinski's Rule of Five, AE-848/32013003 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/32013003?
The CAS number of AE-848/32013003 is 300669-72-1.
What is the molecular formula of AE-848/32013003?
The molecular formula of AE-848/32013003 is C28H25N3O2S2.
What is the molecular weight of AE-848/32013003?
The molecular weight of AE-848/32013003 is 499.14 g/mol.
Where can I buy AE-848/32013003?
You can request a quote for AE-848/32013003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/32013003?
Yes, KEHONG BIO provides custom synthesis services for AE-848/32013003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.