1,3'-Bis(3-chloro-4-tolyl)urea
TL;DR: 1,3'-Bis(3-chloro-4-tolyl)urea (CAS 107947-94-4) 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(3-chloro-4-methylphenyl)urea
Also Known As: 1,3-bis(3-chloro-4-methylphenyl)urea, N,N'-bis(3-chloro-4-methylphenyl)urea, 1,3'-Bis(3-chloro-4-tolyl)urea, N,N'-Bis(3-chloro-4-tolyl)urea, 1,3-bis(3-chloro-4-methyl-phenyl)urea
| Molecular Formula | C15H14Cl2N2O |
|---|---|
| Molecular Weight | 308.05 g/mol |
| LogP | 5.1 |
| 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 | 107947-94-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)C)Cl)Cl |
| InChIKey | BDKXYSKISJGPRL-UHFFFAOYSA-N |
Product Overview
1,3'-Bis(3-chloro-4-tolyl)urea (CAS 107947-94-4), with molecular formula C15H14Cl2N2O and molecular weight 308.05 g/mol. IUPAC: 1,3-bis(3-chloro-4-methylphenyl)urea.
Chemical Property Profile of 1,3'-Bis(3-chloro-4-tolyl)urea
Property Insights of 1,3'-Bis(3-chloro-4-tolyl)urea
The XLogP value of 5.1 indicates that 1,3'-Bis(3-chloro-4-tolyl)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(3-chloro-4-tolyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3'-Bis(3-chloro-4-tolyl)urea has 2 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 1,3'-Bis(3-chloro-4-tolyl)urea?
The CAS number of 1,3'-Bis(3-chloro-4-tolyl)urea is 107947-94-4.
What is the molecular formula of 1,3'-Bis(3-chloro-4-tolyl)urea?
The molecular formula of 1,3'-Bis(3-chloro-4-tolyl)urea is C15H14Cl2N2O.
What is the molecular weight of 1,3'-Bis(3-chloro-4-tolyl)urea?
The molecular weight of 1,3'-Bis(3-chloro-4-tolyl)urea is 308.05 g/mol.
Where can I buy 1,3'-Bis(3-chloro-4-tolyl)urea?
You can request a quote for 1,3'-Bis(3-chloro-4-tolyl)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(3-chloro-4-tolyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1,3'-Bis(3-chloro-4-tolyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.