![N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide structure](/static/products/7276/727674-01-3.webp)
N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide
TL;DR: N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide (CAS 727674-01-3) is a chemical compound with molecular formula C23H31N3O2S and molecular weight 413.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide
Also Known As: N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide, A3765/0159685, N-{[4-(4-methoxyphenyl)piperazin-1-yl]carbonothioyl}adamantane-1-carboxamide, N-{[4-(4-methoxyphenyl)piperazin-1-yl]carbonothioyl}tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
| Molecular Formula | C23H31N3O2S |
|---|---|
| Molecular Weight | 413.21 g/mol |
| LogP | 3.4347 |
| Topological Polar Surface Area | 44.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.21368 |
| Heavy Atoms | 29 |
| Complexity | 750.5334 |
Chemical Identifiers
| CAS Number | 727674-01-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC(=O)C34CC5CC(C3)CC(C5)C4 |
Product Overview
N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide (CAS 727674-01-3), with molecular formula C23H31N3O2S and molecular weight 413.21 g/mol. IUPAC: N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide.
Chemical Property Profile of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide
Property Insights of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide
The XLogP value of 3.4347 indicates that N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.81 Ų, N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide has 1 hydrogen bond donor(s) and 4 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-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide?
The CAS number of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide is 727674-01-3.
What is the molecular formula of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide?
The molecular formula of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide is C23H31N3O2S.
What is the molecular weight of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide?
The molecular weight of N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide is 413.21 g/mol.
Where can I buy N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide?
You can request a quote for N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(4-methoxyphenyl)piperazine-1-carbothioyl]adamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.