5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one
TL;DR: 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one (CAS 6178-30-9) 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.
5-(1-adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 5-(1-adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one, BIM-0042065.P001, 5-(1-adamantyl)-3-ethyl-2-mercapto-3,5-dihydro-4H-imidazol-4-one, 5-(ADAMANTAN-1-YL)-3-ETHYL-2-SULFANYLIDENEIMIDAZOLIDIN-4-ONE
| Molecular Formula | C15H22N2OS |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | 2.308 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.1453 |
| Heavy Atoms | 19 |
| Complexity | 412.1423 |
Chemical Identifiers
| CAS Number | 6178-30-9 |
|---|---|
| SMILES | CCN1C(=O)C(NC1=S)C23CC4CC(C2)CC(C4)C3 |
Product Overview
5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one (CAS 6178-30-9), with molecular formula C15H22N2OS and molecular weight 278.15 g/mol. IUPAC: 5-(1-adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one
Property Insights of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one
The XLogP value of 2.308 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one. With a topological polar surface area (TPSA) of 32.34 Ų, 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one has 1 hydrogen bond donor(s) and 2 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-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one?
The CAS number of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one is 6178-30-9.
What is the molecular formula of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one?
The molecular formula of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one is C15H22N2OS.
What is the molecular weight of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one?
The molecular weight of 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one is 278.15 g/mol.
Where can I buy 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one?
You can request a quote for 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(1-Adamantyl)-3-ethyl-2-sulfanylideneimidazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.