AN-465/14954212
TL;DR: AN-465/14954212 (CAS 445409-95-0) is a chemical compound with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(1-ethylindol-3-yl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AN-465/14954212, (5E)-5-[(1-ethylindol-3-yl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[(1-ethyl-1H-indol-3-yl)methylene]-1-(4-methylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione, (5E)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(4-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (E)-5-((1-ethyl-1H-indol-3-yl)methylene)-2-thioxo-1-(p-tolyl)dihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C22H19N3O2S |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 3.80092 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.1198 |
| Heavy Atoms | 28 |
| Complexity | 1142.3032 |
Chemical Identifiers
| CAS Number | 445409-95-0 |
|---|---|
| SMILES | CCN1C=C(C2=CC=CC=C21)/C=C/3\C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C |
Product Overview
AN-465/14954212 (CAS 445409-95-0), with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol. IUPAC: (5E)-5-[(1-ethylindol-3-yl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AN-465/14954212
Property Insights of AN-465/14954212
The XLogP value of 3.80092 indicates that AN-465/14954212 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.34 Ų, AN-465/14954212 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-465/14954212 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 AN-465/14954212?
The CAS number of AN-465/14954212 is 445409-95-0.
What is the molecular formula of AN-465/14954212?
The molecular formula of AN-465/14954212 is C22H19N3O2S.
What is the molecular weight of AN-465/14954212?
The molecular weight of AN-465/14954212 is 389.12 g/mol.
Where can I buy AN-465/14954212?
You can request a quote for AN-465/14954212 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/14954212?
Yes, KEHONG BIO provides custom synthesis services for AN-465/14954212 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.