1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea
TL;DR: 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea (CAS 896254-55-0) is a chemical compound with molecular formula C13H14Cl2N4O and molecular weight 312.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)urea
Also Known As: 1-(3,4-dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea, 1-(3,4-dichlorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)urea, N-(3,4-Dichlorophenyl)-N'-(1,3,5-trimethyl-1H-pyrazol-4-yl)urea
| Molecular Formula | C13H14Cl2N4O |
|---|---|
| Molecular Weight | 312.05 g/mol |
| LogP | 3.98774 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.05447 |
| Heavy Atoms | 20 |
| Complexity | 666.63104 |
Chemical Identifiers
| CAS Number | 896254-55-0 |
|---|---|
| SMILES | CC1=C(C(=NN1C)C)NC(=O)NC2=CC(=C(C=C2)Cl)Cl |
Product Overview
1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea (CAS 896254-55-0), with molecular formula C13H14Cl2N4O and molecular weight 312.05 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)urea.
Chemical Property Profile of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea
Property Insights of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea
The XLogP value of 3.98774 indicates that 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.95 Ų, 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea has 2 hydrogen bond donor(s) and 2 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-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea?
The CAS number of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea is 896254-55-0.
What is the molecular formula of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea?
The molecular formula of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea is C13H14Cl2N4O.
What is the molecular weight of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea?
The molecular weight of 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea is 312.05 g/mol.
Where can I buy 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea?
You can request a quote for 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorophenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.