![N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea structure](/static/products/5935/5935-51-3.webp)
N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea
TL;DR: N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea (CAS 5935-51-3) is a chemical compound with molecular formula C23H23ClFN3O and molecular weight 411.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-4-fluorophenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea
Also Known As: N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea, 3-(3-chloro-4-fluorophenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea, N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-(prop-2-en-1-yl)urea
| Molecular Formula | C23H23ClFN3O |
|---|---|
| Molecular Weight | 411.15 g/mol |
| LogP | 5.85742 |
| Topological Polar Surface Area | 37.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.15137 |
| Heavy Atoms | 29 |
| Complexity | 1014.8625 |
Chemical Identifiers
| CAS Number | 5935-51-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC(=C(C=C3)F)Cl |
Product Overview
N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea (CAS 5935-51-3), with molecular formula C23H23ClFN3O and molecular weight 411.15 g/mol. IUPAC: 3-(3-chloro-4-fluorophenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea.
Chemical Property Profile of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea
Property Insights of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea
The XLogP value of 5.85742 indicates that N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.27 Ų, N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea 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 N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea?
The CAS number of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea is 5935-51-3.
What is the molecular formula of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea?
The molecular formula of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea is C23H23ClFN3O.
What is the molecular weight of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea?
The molecular weight of N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea is 411.15 g/mol.
Where can I buy N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea?
You can request a quote for N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea?
Yes, KEHONG BIO provides custom synthesis services for N'-(3-Chloro-4-fluorophenyl)-N-({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-prop-2-en-1-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.