![3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea structure](/static/products/4942/494216-91-0.webp)
3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea
TL;DR: 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea (CAS 494216-91-0) is a chemical compound with molecular formula C29H31N3O3S and molecular weight 501.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea
Also Known As: 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea, N'-(2,6-DIMETHYLPHENYL)-N-(2-METHOXYPHENETHYL)-N-[1-(4-METHYLPHENYL)-2,5-DIOXOTETRAHYDRO-1H-PYRROL-3-YL]THIOUREA, N'-(2,6-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]-N-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thiourea
| Molecular Formula | C29H31N3O3S |
|---|---|
| Molecular Weight | 501.21 g/mol |
| LogP | 5.19406 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.20862 |
| Heavy Atoms | 36 |
| Complexity | 1268.9268 |
Chemical Identifiers
| CAS Number | 494216-91-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3OC)C(=S)NC4=C(C=CC=C4C)C |
Product Overview
3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea (CAS 494216-91-0), with molecular formula C29H31N3O3S and molecular weight 501.21 g/mol. IUPAC: 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea.
Chemical Property Profile of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea
Property Insights of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea
The XLogP value of 5.19406 indicates that 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea. Following Lipinski's Rule of Five, 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea?
The CAS number of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea is 494216-91-0.
What is the molecular formula of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea?
The molecular formula of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea is C29H31N3O3S.
What is the molecular weight of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea?
The molecular weight of 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea is 501.21 g/mol.
Where can I buy 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea?
You can request a quote for 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,6-dimethylphenyl)-1-[2-(2-methoxyphenyl)ethyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.