1-(4-Ethylphenyl)-3-propan-2-ylurea
TL;DR: 1-(4-Ethylphenyl)-3-propan-2-ylurea (CAS 449789-96-2) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethylphenyl)-3-propan-2-ylurea
Also Known As: 1-(4-ethylphenyl)-3-propan-2-ylurea, UREA, N-(4-ETHYLPHENYL)-N-(1-METHYLETHYL)- (9CI)
| Molecular Formula | C12H18N2O |
|---|---|
| Molecular Weight | 206.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.1419 |
| Heavy Atoms | 15 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 449789-96-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)NC(C)C |
| InChIKey | ROVHUPFWXSXKJM-UHFFFAOYSA-N |
Product Overview
1-(4-Ethylphenyl)-3-propan-2-ylurea (CAS 449789-96-2), with molecular formula C12H18N2O and molecular weight 206.14 g/mol. IUPAC: 1-(4-ethylphenyl)-3-propan-2-ylurea.
Chemical Property Profile of 1-(4-Ethylphenyl)-3-propan-2-ylurea
Property Insights of 1-(4-Ethylphenyl)-3-propan-2-ylurea
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Ethylphenyl)-3-propan-2-ylurea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-(4-Ethylphenyl)-3-propan-2-ylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Ethylphenyl)-3-propan-2-ylurea 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-(4-Ethylphenyl)-3-propan-2-ylurea?
The CAS number of 1-(4-Ethylphenyl)-3-propan-2-ylurea is 449789-96-2.
What is the molecular formula of 1-(4-Ethylphenyl)-3-propan-2-ylurea?
The molecular formula of 1-(4-Ethylphenyl)-3-propan-2-ylurea is C12H18N2O.
What is the molecular weight of 1-(4-Ethylphenyl)-3-propan-2-ylurea?
The molecular weight of 1-(4-Ethylphenyl)-3-propan-2-ylurea is 206.14 g/mol.
Where can I buy 1-(4-Ethylphenyl)-3-propan-2-ylurea?
You can request a quote for 1-(4-Ethylphenyl)-3-propan-2-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Ethylphenyl)-3-propan-2-ylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Ethylphenyl)-3-propan-2-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.