AJ-292/40706500
TL;DR: AJ-292/40706500 (CAS 428826-34-0) is a chemical compound with molecular formula C23H26N2OS and molecular weight 378.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-6-oxo-N-phenyl-2-(2-phenylethylamino)cyclohexene-1-carbothioamide
Also Known As: AJ-292/40706500, 4,4-dimethyl-6-oxo-N-phenyl-2-[(2-phenylethyl)amino]cyclohex-1-ene-1-carbothioamide, 4,4-dimethyl-6-oxo-N-phenyl-2-(2-phenylethylamino)cyclohexene-1-carbothioamide, 4,4-dimethyl-6-oxo-2-(phenethylamino)-N-phenylcyclohexene-1-carbothioamide, 4,4-dimethyl-6-oxo-N-phenyl-2-[(2-phenylethyl)amino]-1-cyclohexene-1-carbothioamide
| Molecular Formula | C23H26N2OS |
|---|---|
| Molecular Weight | 378.18 g/mol |
| LogP | 4.9014 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.17657 |
| Heavy Atoms | 27 |
| Complexity | 841.1968 |
Chemical Identifiers
| CAS Number | 428826-34-0 |
|---|---|
| SMILES | CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=CC=C2)NCCC3=CC=CC=C3)C |
Product Overview
AJ-292/40706500 (CAS 428826-34-0), with molecular formula C23H26N2OS and molecular weight 378.18 g/mol. IUPAC: 4,4-dimethyl-6-oxo-N-phenyl-2-(2-phenylethylamino)cyclohexene-1-carbothioamide.
Chemical Property Profile of AJ-292/40706500
Property Insights of AJ-292/40706500
The XLogP value of 4.9014 indicates that AJ-292/40706500 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, AJ-292/40706500 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/40706500 has 2 hydrogen bond donor(s) and 3 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 AJ-292/40706500?
The CAS number of AJ-292/40706500 is 428826-34-0.
What is the molecular formula of AJ-292/40706500?
The molecular formula of AJ-292/40706500 is C23H26N2OS.
What is the molecular weight of AJ-292/40706500?
The molecular weight of AJ-292/40706500 is 378.18 g/mol.
Where can I buy AJ-292/40706500?
You can request a quote for AJ-292/40706500 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40706500?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40706500 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.