![5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/714/714943-65-4.png)
5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 714943-65-4) is a chemical compound with molecular formula C28H23N3O2S and molecular weight 465.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(1-benzylindol-3-yl)methylidene]-1-(2-phenylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-(2-phenylethyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5E)-5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (E)-5-((1-benzyl-1H-indol-3-yl)methylene)-1-phenethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C28H23N3O2S |
|---|---|
| Molecular Weight | 465.15 g/mol |
| LogP | 4.559 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.1511 |
| Heavy Atoms | 34 |
| Complexity | 1407.6375 |
Chemical Identifiers
| CAS Number | 714943-65-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)/C(=O)NC2=S |
Product Overview
5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 714943-65-4), with molecular formula C28H23N3O2S and molecular weight 465.15 g/mol. IUPAC: (5E)-5-[(1-benzylindol-3-yl)methylidene]-1-(2-phenylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 4.559 indicates that 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.34 Ų, 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione 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 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 714943-65-4.
What is the molecular formula of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione is C28H23N3O2S.
What is the molecular weight of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 465.15 g/mol.
Where can I buy 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(1-benzylindol-3-yl)methylidene]-1-phenethyl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.