1-(2,6-二甲基苯乙基)脲
TL;DR: 1-(2,6-二甲基苯乙基)脲 (CAS 17291-84-8) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-二甲基苯乙基)脲
2-(2,6-dimethylphenyl)ethylurea
Also Known As: 2,6-Dimethylphenethylurea, N-(2,6-Dimethylphenethyl)urea, 2-(2,6-dimethylphenyl)ethylurea, (2,6-Dimethylphenethyl)urea, Urea, 1-(2,6-dimethylphenethyl)-
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 17291-84-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)CCNC(=O)N |
| InChIKey | PIMJYOORDYDRBD-UHFFFAOYSA-N |
Product Overview
1-(2,6-二甲基苯乙基)脲 (CAS 17291-84-8), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: 2-(2,6-dimethylphenyl)ethylurea.
Chemical Property Profile of 1-(2,6-二甲基苯乙基)脲
Property Insights of 1-(2,6-二甲基苯乙基)脲
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-二甲基苯乙基)脲. With a topological polar surface area (TPSA) of 55.1 Ų, 1-(2,6-二甲基苯乙基)脲 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,6-二甲基苯乙基)脲 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
Frequently Asked Questions
What is the CAS number of 1-(2,6-二甲基苯乙基)脲?
The CAS number of 1-(2,6-二甲基苯乙基)脲 is 17291-84-8.
What is the molecular formula of 1-(2,6-二甲基苯乙基)脲?
The molecular formula of 1-(2,6-二甲基苯乙基)脲 is C11H16N2O.
What is the molecular weight of 1-(2,6-二甲基苯乙基)脲?
The molecular weight of 1-(2,6-二甲基苯乙基)脲 is 192.13 g/mol.
Where can I buy 1-(2,6-二甲基苯乙基)脲?
You can request a quote for 1-(2,6-二甲基苯乙基)脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-二甲基苯乙基)脲?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-二甲基苯乙基)脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.