N-Benzyl-N'-tert-butylurea
TL;DR: N-Benzyl-N'-tert-butylurea (CAS 15942-15-1) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-3-tert-butylurea
Also Known As: 1-benzyl-3-tert-butylurea, N-Benzyl-N'-tert-butylurea, N-benzyl-N-tert-butylurea, N-benzyl-N'-tert-butyl urea, 1-Benzyl-3-(tert-butyl)urea
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.1419 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.1419 Da |
| Heavy Atoms | 15 |
| Complexity | 202.0 |
| SMILES | CC(C)(C)NC(=O)NCC1=CC=CC=C1 |
| InChIKey | UCRJESGWJZLKCX-UHFFFAOYSA-N |
Chemical Property Profile of N-Benzyl-N'-tert-butylurea
Property Insights of N-Benzyl-N'-tert-butylurea
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyl-N'-tert-butylurea. With a topological polar surface area (TPSA) of 41.1 Ų, N-Benzyl-N'-tert-butylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-N'-tert-butylurea 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-Benzyl-N'-tert-butylurea?
The CAS number of N-Benzyl-N'-tert-butylurea is 15942-15-1.
What is the molecular formula of N-Benzyl-N'-tert-butylurea?
The molecular formula of N-Benzyl-N'-tert-butylurea is C12H18N2O.
What is the molecular weight of N-Benzyl-N'-tert-butylurea?
The molecular weight of N-Benzyl-N'-tert-butylurea is 206.1419 g/mol.
Where can I buy N-Benzyl-N'-tert-butylurea?
You can request a quote for N-Benzyl-N'-tert-butylurea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Benzyl-N'-tert-butylurea?
Yes, CoreyChem provides custom synthesis services for N-Benzyl-N'-tert-butylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.