![1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea structure](/static/products/7019/701926-22-9.webp)
1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea
TL;DR: 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea (CAS 701926-22-9) is a chemical compound with molecular formula C17H17BrClN3OS2 and molecular weight 456.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea
Also Known As: 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea, 2-{[(2-bromobenzyl)sulfanyl]acetyl}-N-(4-chlorobenzyl)hydrazinecarbothioamide, 2-[(2-bromophenyl)methylthio]-N-[({[(4-chlorophenyl)methyl]amino}thioxomethyl) amino]acetamide
| Molecular Formula | C17H17BrClN3OS2 |
|---|---|
| Molecular Weight | 456.97 g/mol |
| LogP | 4.0312 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.96848 |
| Heavy Atoms | 25 |
| Complexity | 728.0878 |
Chemical Identifiers
| CAS Number | 701926-22-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSCC(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)Br |
Product Overview
1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea (CAS 701926-22-9), with molecular formula C17H17BrClN3OS2 and molecular weight 456.97 g/mol. IUPAC: 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea.
Chemical Property Profile of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea
Property Insights of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea
The XLogP value of 4.0312 indicates that 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-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 53.16 Ų, 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea has 3 hydrogen bond donor(s) and 3 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-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea?
The CAS number of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea is 701926-22-9.
What is the molecular formula of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea?
The molecular formula of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea is C17H17BrClN3OS2.
What is the molecular weight of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea?
The molecular weight of 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea is 456.97 g/mol.
Where can I buy 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea?
You can request a quote for 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-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-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-[(4-chlorophenyl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.