1,3-Bis-(5-chloro-2-methylphenyl)urea
TL;DR: 1,3-Bis-(5-chloro-2-methylphenyl)urea (CAS 54965-12-7) is a chemical compound with molecular formula C15H14Cl2N2O and molecular weight 308.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(5-chloro-2-methylphenyl)urea
Also Known As: 1,3-bis(5-chloro-2-methylphenyl)urea, N,N'-Bis(5-chloro-2-methylphenyl)urea, Urea, N,N'-bis(5-chloro-2-methylphenyl)-, 1,3-BIS-(5-CHLORO-2-METHYLPHENYL)UREA, N,N -Bis(5-chloro-2-methylphenyl)urea
| Molecular Formula | C15H14Cl2N2O |
|---|---|
| Molecular Weight | 308.05 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.0483 |
| Heavy Atoms | 20 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 54965-12-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(=O)NC2=C(C=CC(=C2)Cl)C |
| InChIKey | OKMNQSHZGJLOOK-UHFFFAOYSA-N |
Product Overview
1,3-Bis-(5-chloro-2-methylphenyl)urea (CAS 54965-12-7), with molecular formula C15H14Cl2N2O and molecular weight 308.05 g/mol. IUPAC: 1,3-bis(5-chloro-2-methylphenyl)urea.
Chemical Property Profile of 1,3-Bis-(5-chloro-2-methylphenyl)urea
Property Insights of 1,3-Bis-(5-chloro-2-methylphenyl)urea
The XLogP value of 4.2 indicates that 1,3-Bis-(5-chloro-2-methylphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 1,3-Bis-(5-chloro-2-methylphenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis-(5-chloro-2-methylphenyl)urea has 2 hydrogen bond donor(s) and 1 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-Bis-(5-chloro-2-methylphenyl)urea?
The CAS number of 1,3-Bis-(5-chloro-2-methylphenyl)urea is 54965-12-7.
What is the molecular formula of 1,3-Bis-(5-chloro-2-methylphenyl)urea?
The molecular formula of 1,3-Bis-(5-chloro-2-methylphenyl)urea is C15H14Cl2N2O.
What is the molecular weight of 1,3-Bis-(5-chloro-2-methylphenyl)urea?
The molecular weight of 1,3-Bis-(5-chloro-2-methylphenyl)urea is 308.05 g/mol.
Where can I buy 1,3-Bis-(5-chloro-2-methylphenyl)urea?
You can request a quote for 1,3-Bis-(5-chloro-2-methylphenyl)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-Bis-(5-chloro-2-methylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis-(5-chloro-2-methylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.