1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea
TL;DR: 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea (CAS 431909-41-0) is a chemical compound with molecular formula C16H16Cl2N2OS and molecular weight 354.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea
Also Known As: 1-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea, 1-{2-[(3,4-dichlorobenzyl)sulfanyl]ethyl}-3-phenylurea
| Molecular Formula | C16H16Cl2N2OS |
|---|---|
| Molecular Weight | 354.04 g/mol |
| LogP | 5.0483 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.03604 |
| Heavy Atoms | 22 |
| Complexity | 622.7978 |
Chemical Identifiers
| CAS Number | 431909-41-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NCCSCC2=CC(=C(C=C2)Cl)Cl |
Product Overview
1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea (CAS 431909-41-0), with molecular formula C16H16Cl2N2OS and molecular weight 354.04 g/mol. IUPAC: 1-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea.
Chemical Property Profile of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea
Property Insights of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea
The XLogP value of 5.0483 indicates that 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea has 2 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 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea?
The CAS number of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea is 431909-41-0.
What is the molecular formula of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea?
The molecular formula of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea is C16H16Cl2N2OS.
What is the molecular weight of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea?
The molecular weight of 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea is 354.04 g/mol.
Where can I buy 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea?
You can request a quote for 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-[(3,4-Dichlorophenyl)methylsulfanyl]ethyl]-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.