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N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea
TL;DR: N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea (CAS 338752-77-5) is a chemical compound with molecular formula C12H16Cl2N2OS2 and molecular weight 338.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(ethylsulfanyl)methyl]-3-(2,4-dichlorophenyl)urea
Also Known As: N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea, 3-[bis(ethylsulfanyl)methyl]-1-(2,4-dichlorophenyl)urea, 1-[bis(ethylsulfanyl)methyl]-3-(2,4-dichlorophenyl)urea, N-Bis(ethylsulfanyl)methyl-N'-(2,4-dichlorophenyl)urea, C12H16Cl2N2OS2
| Molecular Formula | C12H16Cl2N2OS2 |
|---|---|
| Molecular Weight | 338.01 g/mol |
| LogP | 4.9047 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.00812 |
| Heavy Atoms | 19 |
| Complexity | 426.19046 |
Chemical Identifiers
| CAS Number | 338752-77-5 |
|---|---|
| SMILES | CCSC(NC(=O)NC1=C(C=C(C=C1)Cl)Cl)SCC |
Product Overview
N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea (CAS 338752-77-5), with molecular formula C12H16Cl2N2OS2 and molecular weight 338.01 g/mol. IUPAC: 1-[bis(ethylsulfanyl)methyl]-3-(2,4-dichlorophenyl)urea.
Chemical Property Profile of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea
Property Insights of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea
The XLogP value of 4.9047 indicates that N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea has 2 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 N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea?
The CAS number of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea is 338752-77-5.
What is the molecular formula of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea?
The molecular formula of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea is C12H16Cl2N2OS2.
What is the molecular weight of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea?
The molecular weight of N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea is 338.01 g/mol.
Where can I buy N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea?
You can request a quote for N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-[bis(ethylsulfanyl)methyl]-N'-(2,4-dichlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.