1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea
TL;DR: 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea (CAS 15278-16-7) is a chemical compound with molecular formula C11H15ClN2O and molecular weight 226.0873 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-(4-chlorophenyl)-2-methylpropan-2-yl]urea
Also Known As: 1-[1-(4-chlorophenyl)-2-methylpropan-2-yl]urea, [1-(4-chlorophenyl)-2-methylpropan-2-yl]urea, KST-1B0637, 2-hydroxybenzoic acid-copper(1:1), N-(p-CHLORO-alpha,alpha-DIMETHYL PHENETHYL)UREA
Technical Specifications
| Molecular Formula | C11H15ClN2O |
| Molecular Weight | 226.0873 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.0873 Da |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
| SMILES | CC(C)(CC1=CC=C(C=C1)Cl)NC(=O)N |
| InChIKey | MZDCMPNXLKPWAH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea
Property Insights of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea. With a topological polar surface area (TPSA) of 55.1 Ų, 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea 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 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea?
The CAS number of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea is 15278-16-7.
What is the molecular formula of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea?
The molecular formula of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea is C11H15ClN2O.
What is the molecular weight of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea?
The molecular weight of 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea is 226.0873 g/mol.
Where can I buy 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea?
You can request a quote for 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea?
Yes, CoreyChem provides custom synthesis services for 1-(4-Chloro-alpha,alpha-dimethylphenethyl)-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.