(3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
TL;DR: (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone (CAS 851863-03-1) is a chemical compound with molecular formula C15H22N2OS and molecular weight 278.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-adamantyl-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
Also Known As: F0630-0006, 1-adamantyl-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone, (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
| Molecular Formula | C15H22N2OS |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | 2.764 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.1453 |
| Heavy Atoms | 19 |
| Complexity | 410.1423 |
Chemical Identifiers
| CAS Number | 851863-03-1 |
|---|---|
| SMILES | CSC1=NCCN1C(=O)C23CC4CC(C2)CC(C4)C3 |
Product Overview
(3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone (CAS 851863-03-1), with molecular formula C15H22N2OS and molecular weight 278.15 g/mol. IUPAC: 1-adamantyl-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone.
Chemical Property Profile of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
Property Insights of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
The XLogP value of 2.764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone. With a topological polar surface area (TPSA) of 32.67 Ų, (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone has 0 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 (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
The CAS number of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone is 851863-03-1.
What is the molecular formula of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
The molecular formula of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone is C15H22N2OS.
What is the molecular weight of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
The molecular weight of (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone is 278.15 g/mol.
Where can I buy (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
You can request a quote for (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3r,5r,7r)-adamantan-1-yl(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.