5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 714283-77-9) is a chemical compound with molecular formula C30H25N3O2S and molecular weight 491.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,3-diphenylpropyliminomethyl)-6-hydroxy-1-naphthalen-1-yl-2-sulfanylidenepyrimidin-4-one
Also Known As: 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-{[(3,3-diphenylpropyl)amino]methylidene}-1-(naphthalen-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (Z)-5-(((3,3-diphenylpropyl)amino)methylene)-1-(naphthalen-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C30H25N3O2S |
|---|---|
| Molecular Weight | 491.17 g/mol |
| LogP | 6.39499 |
| Topological Polar Surface Area | 70.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.16675 |
| Heavy Atoms | 36 |
| Complexity | 1595.8549 |
Chemical Identifiers
| CAS Number | 714283-77-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CCN=CC2=C(N(C(=S)NC2=O)C3=CC=CC4=CC=CC=C43)O)C5=CC=CC=C5 |
Product Overview
5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 714283-77-9), with molecular formula C30H25N3O2S and molecular weight 491.17 g/mol. IUPAC: 5-(3,3-diphenylpropyliminomethyl)-6-hydroxy-1-naphthalen-1-yl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 6.39499 indicates that 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is 714283-77-9.
What is the molecular formula of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is C30H25N3O2S.
What is the molecular weight of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione is 491.17 g/mol.
Where can I buy 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-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-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(3,3-diphenylpropylamino)methylidene]-1-naphthalen-1-yl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.