2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate
TL;DR: 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate (CAS 339197-58-9) is a chemical compound with molecular formula C18H25N3O3S and molecular weight 363.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl] N,N'-diethylcarbamimidothioate
Also Known As: 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate, A0918/0042976, [2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl] N,N'-diethylcarbamimidothioate, 2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl N,N'-diethylcarbamimidothioate, (E)-1-{[2,5-DIOXO-1-(4-PROPOXYPHENYL)PYRROLIDIN-3-YL]SULFANYL}-N,N'-DIETHYLMETHANIMIDAMIDE
| Molecular Formula | C18H25N3O3S |
|---|---|
| Molecular Weight | 363.16 g/mol |
| LogP | 2.8259 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.16165 |
| Heavy Atoms | 25 |
| Complexity | 630.9584 |
Chemical Identifiers
| CAS Number | 339197-58-9 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC(=NCC)NCC |
Product Overview
2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate (CAS 339197-58-9), with molecular formula C18H25N3O3S and molecular weight 363.16 g/mol. IUPAC: [2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl] N,N'-diethylcarbamimidothioate.
Chemical Property Profile of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate
Property Insights of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate
The XLogP value of 2.8259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate. Following Lipinski's Rule of Five, 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate has 1 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 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate?
The CAS number of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate is 339197-58-9.
What is the molecular formula of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate?
The molecular formula of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate is C18H25N3O3S.
What is the molecular weight of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate?
The molecular weight of 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate is 363.16 g/mol.
Where can I buy 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate?
You can request a quote for 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl N,N'-diethylimidothiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.