AJ-292/40960078
TL;DR: AJ-292/40960078 (CAS 372501-93-4) is a chemical compound with molecular formula C26H25N3O2S and molecular weight 443.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(1-benzylindol-3-yl)methylidene]-1-cyclohexyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AJ-292/40960078, 5-[(1-benzylindol-3-yl)methylidene]-1-cyclohexyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-cyclohexyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5Z)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-cyclohexyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5Z)-5-[(1-benzylindol-3-yl)methylidene]-1-cyclohexyl-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C26H25N3O2S |
|---|---|
| Molecular Weight | 443.17 g/mol |
| LogP | 4.649 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.16675 |
| Heavy Atoms | 32 |
| Complexity | 1222.3577 |
Chemical Identifiers
| CAS Number | 372501-93-4 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=O)/C(=C\C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)/C(=O)NC2=S |
Product Overview
AJ-292/40960078 (CAS 372501-93-4), with molecular formula C26H25N3O2S and molecular weight 443.17 g/mol. IUPAC: (5Z)-5-[(1-benzylindol-3-yl)methylidene]-1-cyclohexyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AJ-292/40960078
Property Insights of AJ-292/40960078
The XLogP value of 4.649 indicates that AJ-292/40960078 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.34 Ų, AJ-292/40960078 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/40960078 has 1 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-292/40960078?
The CAS number of AJ-292/40960078 is 372501-93-4.
What is the molecular formula of AJ-292/40960078?
The molecular formula of AJ-292/40960078 is C26H25N3O2S.
What is the molecular weight of AJ-292/40960078?
The molecular weight of AJ-292/40960078 is 443.17 g/mol.
Where can I buy AJ-292/40960078?
You can request a quote for AJ-292/40960078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40960078?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40960078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.