![5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/369/369607-24-9.png)
5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 369607-24-9) is a chemical compound with molecular formula C18H23N3O2S and molecular weight 345.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-adamantyliminomethyl)-6-hydroxy-1-prop-2-enyl-2-sulfanylidenepyrimidin-4-one
Also Known As: 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[(1-adamantylamino)methylene]-1-allyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione, (5Z)-6-hydroxy-3-(prop-2-en-1-yl)-2-thioxo-5-[(tricyclo[3.3.1.1~3,7~]dec-1-ylamino)methylidene]-2,5-dihydropyrimidin-4(3H)-one, (Z)-5-(((3s,5s,7s)-adamantan-1-ylamino)methylene)-1-allyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C18H23N3O2S |
|---|---|
| Molecular Weight | 345.15 g/mol |
| LogP | 3.18519 |
| Topological Polar Surface Area | 70.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.1511 |
| Heavy Atoms | 24 |
| Complexity | 785.2491 |
Chemical Identifiers
| CAS Number | 369607-24-9 |
|---|---|
| SMILES | C=CCN1C(=C(C(=O)NC1=S)C=NC23CC4CC(C2)CC(C4)C3)O |
Product Overview
5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 369607-24-9), with molecular formula C18H23N3O2S and molecular weight 345.15 g/mol. IUPAC: 5-(1-adamantyliminomethyl)-6-hydroxy-1-prop-2-enyl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 3.18519 indicates that 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-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-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione has 2 hydrogen bond donor(s) and 4 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-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 369607-24-9.
What is the molecular formula of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione is C18H23N3O2S.
What is the molecular weight of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 345.15 g/mol.
Where can I buy 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-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-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(1-adamantylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.