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1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea
TL;DR: 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea (CAS 107774-96-9) is a chemical compound with molecular formula C14H12Cl2N2S and molecular weight 310.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea
Also Known As: KSC-13-34, 1-(4-chlorobenzyl)-3-(3-chlorophenyl)thiourea, AB00106912-01, AB00106912-03, 1-(3-chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea
| Molecular Formula | C14H12Cl2N2S |
|---|---|
| Molecular Weight | 310.01 g/mol |
| LogP | 4.48 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.00983 |
| Heavy Atoms | 19 |
| Complexity | 569.9136 |
Chemical Identifiers
| CAS Number | 107774-96-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=S)NCC2=CC=C(C=C2)Cl |
Product Overview
1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea (CAS 107774-96-9), with molecular formula C14H12Cl2N2S and molecular weight 310.01 g/mol. IUPAC: 1-(3-chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea.
Chemical Property Profile of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea
Property Insights of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea
The XLogP value of 4.48 indicates that 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea 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-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea?
The CAS number of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea is 107774-96-9.
What is the molecular formula of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea?
The molecular formula of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea is C14H12Cl2N2S.
What is the molecular weight of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea?
The molecular weight of 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea is 310.01 g/mol.
Where can I buy 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea?
You can request a quote for 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chlorophenyl)-3-[(4-chlorophenyl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.