![(2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide structure](/static/products/530/530128-29-1.png)
(2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide
TL;DR: (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide (CAS 530128-29-1) is a chemical compound with molecular formula C23H30N2OS and molecular weight 382.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(1-adamantylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
Also Known As: (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide, (E)-N-(1-adamantylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide, (E)-N-((3s,5s,7s)-adamantan-1-ylcarbamothioyl)-3-(4-isopropylphenyl)acrylamide
| Molecular Formula | C23H30N2OS |
|---|---|
| Molecular Weight | 382.21 g/mol |
| LogP | 4.7827 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.2079 |
| Heavy Atoms | 27 |
| Complexity | 714.86255 |
Chemical Identifiers
| CAS Number | 530128-29-1 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
(2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide (CAS 530128-29-1), with molecular formula C23H30N2OS and molecular weight 382.21 g/mol. IUPAC: (E)-N-(1-adamantylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide.
Chemical Property Profile of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide
Property Insights of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide
The XLogP value of 4.7827 indicates that (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide has 2 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 (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide?
The CAS number of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide is 530128-29-1.
What is the molecular formula of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide?
The molecular formula of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide is C23H30N2OS.
What is the molecular weight of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide?
The molecular weight of (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide is 382.21 g/mol.
Where can I buy (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide?
You can request a quote for (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)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 (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[4-(propan-2-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.