![3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea structure](/static/products/849/84919-08-4.png)
3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea
TL;DR: 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea (CAS 84919-08-4) is a chemical compound with molecular formula C23H23N3S2 and molecular weight 405.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N'-(benzylcarbamothioyl)-N-methyl-N-phenylcarbamimidothioate
Also Known As: benzyl N'-(benzylcarbamothioyl)-N-methyl-N-phenylcarbamimidothioate, benzyl N'-(benzylcarbamothioyl)-N-methyl-N-phenylcarbamimido, 3-benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea
| Molecular Formula | C23H23N3S2 |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 5.4869 |
| Topological Polar Surface Area | 27.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.13333 |
| Heavy Atoms | 28 |
| Complexity | 896.905 |
Chemical Identifiers
| CAS Number | 84919-08-4 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=NC(=S)NCC2=CC=CC=C2)SCC3=CC=CC=C3 |
Product Overview
3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea (CAS 84919-08-4), with molecular formula C23H23N3S2 and molecular weight 405.13 g/mol. IUPAC: benzyl N'-(benzylcarbamothioyl)-N-methyl-N-phenylcarbamimidothioate.
Chemical Property Profile of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea
Property Insights of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea
The XLogP value of 5.4869 indicates that 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.63 Ų, 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea?
The CAS number of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea is 84919-08-4.
What is the molecular formula of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea?
The molecular formula of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea is C23H23N3S2.
What is the molecular weight of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea?
The molecular weight of 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea is 405.13 g/mol.
Where can I buy 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea?
You can request a quote for 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-1-[benzylsulfanyl-(methyl-phenyl-amino)methylidene]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.