![[2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate structure](/static/products/852/852556-66-2.png)
[2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate
TL;DR: [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate (CAS 852556-66-2) is a chemical compound with molecular formula C15H20N2O2S2 and molecular weight 324.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate
Also Known As: [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate|2-{[(4-Methoxyphenyl)methyl]amino}-2-oxoethyl pyrrolidine-1-carbodithioate|MLS002157975|SMR001240454
| Molecular Formula | C15H20N2O2S2 |
|---|---|
| Molecular Weight | 324.10 g/mol |
| LogP | 2.4253 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.09662 |
| Heavy Atoms | 21 |
| Complexity | 484.9519 |
Chemical Identifiers
| CAS Number | 852556-66-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC(=O)CSC(=S)N2CCCC2 |
Product Overview
[2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate (CAS 852556-66-2), with molecular formula C15H20N2O2S2 and molecular weight 324.10 g/mol. IUPAC: [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate.
Chemical Property Profile of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate
Property Insights of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate
The XLogP value of 2.4253 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate. With a topological polar surface area (TPSA) of 41.57 Ų, [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate 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 [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate?
The CAS number of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate is 852556-66-2.
What is the molecular formula of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate?
The molecular formula of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate is C15H20N2O2S2.
What is the molecular weight of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate?
The molecular weight of [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate is 324.10 g/mol.
Where can I buy [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate?
You can request a quote for [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] pyrrolidine-1-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.