1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
TL;DR: 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone (CAS 851863-69-9) is a chemical compound with molecular formula C21H26N2OS and molecular weight 354.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
Also Known As: 1-(adamantane-1-carbonyl)-2-(benzylsulfanyl)-4,5-dihydro-1H-imidazole, 1-adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone, F0630-0190, (3r,5r,7r)-adamantan-1-yl(2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
| Molecular Formula | C21H26N2OS |
|---|---|
| Molecular Weight | 354.18 g/mol |
| LogP | 4.3344 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.17657 |
| Heavy Atoms | 25 |
| Complexity | 663.8232 |
Chemical Identifiers
| CAS Number | 851863-69-9 |
|---|---|
| SMILES | C1CN(C(=N1)SCC2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4 |
Product Overview
1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone (CAS 851863-69-9), with molecular formula C21H26N2OS and molecular weight 354.18 g/mol. IUPAC: 1-adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone.
Chemical Property Profile of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
Property Insights of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
The XLogP value of 4.3344 indicates that 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-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 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone?
The CAS number of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone is 851863-69-9.
What is the molecular formula of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone?
The molecular formula of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone is C21H26N2OS.
What is the molecular weight of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone?
The molecular weight of 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone is 354.18 g/mol.
Where can I buy 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone?
You can request a quote for 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-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 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantyl-(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.