4,4'-Dichlorocarbanilide
TL;DR: 4,4'-Dichlorocarbanilide (CAS 1219-99-4) is a chemical compound with molecular formula C13H10Cl2N2O and molecular weight 280.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(4-chlorophenyl)urea
Also Known As: 1,3-bis(4-chlorophenyl)urea, 4,4'-Dichlorocarbanilide, N,N'-bis(4-chlorophenyl)urea, n,n'-bis(p-chlorophenyl)urea, Urea-based compound,9
| Molecular Formula | C13H10Cl2N2O |
|---|---|
| Molecular Weight | 280.02 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.01703 |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 1219-99-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)Cl)Cl |
| InChIKey | ZNQCSLYENQIUMJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Dichlorocarbanilide (CAS 1219-99-4), with molecular formula C13H10Cl2N2O and molecular weight 280.02 g/mol. IUPAC: 1,3-bis(4-chlorophenyl)urea.
Chemical Property Profile of 4,4'-Dichlorocarbanilide
Property Insights of 4,4'-Dichlorocarbanilide
The XLogP value of 4.3 indicates that 4,4'-Dichlorocarbanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 4,4'-Dichlorocarbanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Dichlorocarbanilide 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 4,4'-Dichlorocarbanilide?
The CAS number of 4,4'-Dichlorocarbanilide is 1219-99-4.
What is the molecular formula of 4,4'-Dichlorocarbanilide?
The molecular formula of 4,4'-Dichlorocarbanilide is C13H10Cl2N2O.
What is the molecular weight of 4,4'-Dichlorocarbanilide?
The molecular weight of 4,4'-Dichlorocarbanilide is 280.02 g/mol.
Where can I buy 4,4'-Dichlorocarbanilide?
You can request a quote for 4,4'-Dichlorocarbanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dichlorocarbanilide?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dichlorocarbanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.