(E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide
TL;DR: (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide (CAS 532404-72-1) is a chemical compound with molecular formula C18H22N2O2S and molecular weight 330.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide
Also Known As: (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide, (2E)-3-(furan-2-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide, (E)-N-((3s,5s,7s)-adamantan-1-ylcarbamothioyl)-3-(furan-2-yl)acrylamide
| Molecular Formula | C18H22N2O2S |
|---|---|
| Molecular Weight | 330.14 g/mol |
| LogP | 3.2523 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.1402 |
| Heavy Atoms | 23 |
| Complexity | 600.17236 |
Chemical Identifiers
| CAS Number | 532404-72-1 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)/C=C/C4=CC=CO4 |
Product Overview
(E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide (CAS 532404-72-1), with molecular formula C18H22N2O2S and molecular weight 330.14 g/mol. IUPAC: (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide.
Chemical Property Profile of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide
Property Insights of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide
The XLogP value of 3.2523 indicates that (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.27 Ų, (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide has 2 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 (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide?
The CAS number of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide is 532404-72-1.
What is the molecular formula of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide?
The molecular formula of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide is C18H22N2O2S.
What is the molecular weight of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide?
The molecular weight of (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide is 330.14 g/mol.
Where can I buy (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide?
You can request a quote for (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(1-adamantylcarbamothioyl)-3-(furan-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.