N-(1-adamantylcarbamothioyl)-4-propoxybenzamide
TL;DR: N-(1-adamantylcarbamothioyl)-4-propoxybenzamide (CAS 532957-40-7) is a chemical compound with molecular formula C21H28N2O2S and molecular weight 372.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantylcarbamothioyl)-4-propoxybenzamide
Also Known As: N-(1-adamantylcarbamothioyl)-4-propoxybenzamide, N-(1-adamantyl)-N'-(4-propoxybenzoyl)thiourea, AO-365/41546439, 4-propoxy-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)benzamide
| Molecular Formula | C21H28N2O2S |
|---|---|
| Molecular Weight | 372.19 g/mol |
| LogP | 4.0485 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.18716 |
| Heavy Atoms | 26 |
| Complexity | 650.4722 |
Chemical Identifiers
| CAS Number | 532957-40-7 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
N-(1-adamantylcarbamothioyl)-4-propoxybenzamide (CAS 532957-40-7), with molecular formula C21H28N2O2S and molecular weight 372.19 g/mol. IUPAC: N-(1-adamantylcarbamothioyl)-4-propoxybenzamide.
Chemical Property Profile of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide
Property Insights of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide
The XLogP value of 4.0485 indicates that N-(1-adamantylcarbamothioyl)-4-propoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-(1-adamantylcarbamothioyl)-4-propoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-adamantylcarbamothioyl)-4-propoxybenzamide 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 N-(1-adamantylcarbamothioyl)-4-propoxybenzamide?
The CAS number of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide is 532957-40-7.
What is the molecular formula of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide?
The molecular formula of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide is C21H28N2O2S.
What is the molecular weight of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide?
The molecular weight of N-(1-adamantylcarbamothioyl)-4-propoxybenzamide is 372.19 g/mol.
Where can I buy N-(1-adamantylcarbamothioyl)-4-propoxybenzamide?
You can request a quote for N-(1-adamantylcarbamothioyl)-4-propoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-adamantylcarbamothioyl)-4-propoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-adamantylcarbamothioyl)-4-propoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.