![1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea structure](/static/products/854/854518-11-9.png)
1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea
TL;DR: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea (CAS 854518-11-9) is a chemical compound with molecular formula C24H26ClF2N3O and molecular weight 445.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea
Also Known As: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea
| Molecular Formula | C24H26ClF2N3O |
|---|---|
| Molecular Weight | 445.17 g/mol |
| LogP | 6.5466 |
| Topological Polar Surface Area | 37.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.17325 |
| Heavy Atoms | 31 |
| Complexity | 1050.8086 |
Chemical Identifiers
| CAS Number | 854518-11-9 |
|---|---|
| SMILES | CC(C)C(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)NC3=C(C=C(C=C3)F)F |
Product Overview
1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea (CAS 854518-11-9), with molecular formula C24H26ClF2N3O and molecular weight 445.17 g/mol. IUPAC: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea.
Chemical Property Profile of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea
Property Insights of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea
The XLogP value of 6.5466 indicates that 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.27 Ų, 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea?
The CAS number of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea is 854518-11-9.
What is the molecular formula of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea?
The molecular formula of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea is C24H26ClF2N3O.
What is the molecular weight of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea?
The molecular weight of 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea is 445.17 g/mol.
Where can I buy 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea?
You can request a quote for 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2,4-difluorophenyl)-1-(3-methylbutan-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.