[2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
TL;DR: [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate (CAS 6077-54-9) is a chemical compound with molecular formula C22H25NO4S and molecular weight 399.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
Also Known As: BIM-0044542.P001, [2-methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate, 2-methoxy-4-[(4-methyl-1-piperidinyl)carbonothioyl]phenyl 4-methoxybenzoate, A2095/0088047, 2-METHOXY-4-(4-METHYLPIPERIDINE-1-CARBOTHIOYL)PHENYL 4-METHOXYBENZOATE
| Molecular Formula | C22H25NO4S |
|---|---|
| Molecular Weight | 399.15 g/mol |
| LogP | 4.3304 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.15042 |
| Heavy Atoms | 28 |
| Complexity | 842.1153 |
Chemical Identifiers
| CAS Number | 6077-54-9 |
|---|---|
| SMILES | CC1CCN(CC1)C(=S)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)OC)OC |
Product Overview
[2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate (CAS 6077-54-9), with molecular formula C22H25NO4S and molecular weight 399.15 g/mol. IUPAC: [2-methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate.
Chemical Property Profile of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
Property Insights of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
The XLogP value of 4.3304 indicates that [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate has 0 hydrogen bond donor(s) and 5 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 [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate?
The CAS number of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate is 6077-54-9.
What is the molecular formula of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate?
The molecular formula of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate is C22H25NO4S.
What is the molecular weight of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate?
The molecular weight of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate is 399.15 g/mol.
Where can I buy [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate?
You can request a quote for [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.