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N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea
TL;DR: N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea (CAS 65609-02-1) 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-[(3,4-dichlorophenyl)methyl]-3-phenylthiourea
Also Known As: N-(3,4-dichlorobenzyl)-N'-phenylthiourea, 1-[(3,4-dichlorophenyl)methyl]-3-phenylthiourea, N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea
| 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 | 572.9136 |
Chemical Identifiers
| CAS Number | 65609-02-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)Cl)Cl |
Product Overview
N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea (CAS 65609-02-1), with molecular formula C14H12Cl2N2S and molecular weight 310.01 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methyl]-3-phenylthiourea.
Chemical Property Profile of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea
Property Insights of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea
The XLogP value of 4.48 indicates that N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea 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 N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea?
The CAS number of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea is 65609-02-1.
What is the molecular formula of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea?
The molecular formula of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea is C14H12Cl2N2S.
What is the molecular weight of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea?
The molecular weight of N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea is 310.01 g/mol.
Where can I buy N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea?
You can request a quote for N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-Dichlorophenyl)methyl]-N'-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.