1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
TL;DR: 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea (CAS 50529-09-4) is a chemical compound with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
Also Known As: 5-22-08-00199 (Beilstein Handbook Reference), 1-(1-methyl-2 -pyrrolidylidene)-3-(2,6-dimethoxyphenyl)urea, 1-(1-methyl-2-pyrrolidylidene)-3-(2,6-dimethoxyphenyl)urea, 1-(2,6-Dimethoxyphenyl)-3-(1-methyl-2-pyrrolidinylidene)urea, 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
| Molecular Formula | C14H19N3O3 |
|---|---|
| Molecular Weight | 277.14 g/mol |
| LogP | 2.3598 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.14264 |
| Heavy Atoms | 20 |
| Complexity | 506.14545 |
Chemical Identifiers
| CAS Number | 50529-09-4 |
|---|---|
| SMILES | CN1CCCC1=NC(=O)NC2=C(C=CC=C2OC)OC |
Product Overview
1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea (CAS 50529-09-4), with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol. IUPAC: 1-(2,6-dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea.
Chemical Property Profile of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
Property Insights of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
The XLogP value of 2.3598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea. Following Lipinski's Rule of Five, 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea has 1 hydrogen bond donor(s) and 3 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 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea?
The CAS number of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea is 50529-09-4.
What is the molecular formula of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea?
The molecular formula of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea is C14H19N3O3.
What is the molecular weight of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea?
The molecular weight of 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea is 277.14 g/mol.
Where can I buy 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea?
You can request a quote for 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.