N-t-butyl-N'-(3,5-dichlorophenyl)thiourea
TL;DR: N-t-butyl-N'-(3,5-dichlorophenyl)thiourea (CAS 134168-84-6) is a chemical compound with molecular formula C11H14Cl2N2S and molecular weight 276.02548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-tert-butyl-3-(3,5-dichlorophenyl)thiourea
Also Known As: N-t-butyl-N'-(3,5-dichlorophenyl)thiourea, 1-tert-butyl-3-(3,5-dichlorophenyl)thiourea, 1-(tert-butyl)-3-(3,5-dichlorophenyl)thiourea
Technical Specifications
| Molecular Formula | C11H14Cl2N2S |
| Molecular Weight | 276.02548 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.02548 Da |
| Heavy Atoms | 16 |
| Complexity | 243.0 |
| SMILES | CC(C)(C)NC(=S)NC1=CC(=CC(=C1)Cl)Cl |
| InChIKey | DYRWNNDBHHTCHH-UHFFFAOYSA-N |
Chemical Property Profile of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea
Property Insights of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea
The XLogP value of 3.8 indicates that N-t-butyl-N'-(3,5-dichlorophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, N-t-butyl-N'-(3,5-dichlorophenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-t-butyl-N'-(3,5-dichlorophenyl)thiourea 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
What is the CAS number of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea?
The CAS number of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea is 134168-84-6.
What is the molecular formula of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea?
The molecular formula of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea is C11H14Cl2N2S.
What is the molecular weight of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea?
The molecular weight of N-t-butyl-N'-(3,5-dichlorophenyl)thiourea is 276.02548 g/mol.
Where can I buy N-t-butyl-N'-(3,5-dichlorophenyl)thiourea?
You can request a quote for N-t-butyl-N'-(3,5-dichlorophenyl)thiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-t-butyl-N'-(3,5-dichlorophenyl)thiourea?
Yes, CoreyChem provides custom synthesis services for N-t-butyl-N'-(3,5-dichlorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.