N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide
TL;DR: N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide (CAS 893331-25-4) is a chemical compound with molecular formula C24H27N3S and molecular weight 389.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide
Also Known As: N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide, N-(4-methylbenzyl)-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide, {[(4-methylphenyl)methyl]amino}[4-(naphthylmethyl)piperazinyl]methane-1-thione
| Molecular Formula | C24H27N3S |
|---|---|
| Molecular Weight | 389.19 g/mol |
| LogP | 4.34052 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.19257 |
| Heavy Atoms | 28 |
| Complexity | 938.2313 |
Chemical Identifiers
| CAS Number | 893331-25-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43 |
Product Overview
N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide (CAS 893331-25-4), with molecular formula C24H27N3S and molecular weight 389.19 g/mol. IUPAC: N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide.
Chemical Property Profile of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide
Property Insights of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide
The XLogP value of 4.34052 indicates that N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide 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 N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide?
The CAS number of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide is 893331-25-4.
What is the molecular formula of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide?
The molecular formula of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide is C24H27N3S.
What is the molecular weight of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide?
The molecular weight of N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide is 389.19 g/mol.
Where can I buy N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide?
You can request a quote for N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-methylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.