Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-
TL;DR: Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- (CAS 87701-35-7) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2-hydroxypropan-2-yl)phenyl]-3-methylurea
Also Known As: Isoproturon metabolite, Hydroxymonodemethylisoproturon, 2-Hydroxymonodesmethylisoproturon, c0812, RPA 415044
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 1.6653 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 338.6007 |
Chemical Identifiers
| CAS Number | 87701-35-7 |
|---|---|
| SMILES | CC(C)(C1=CC=C(C=C1)NC(=O)NC)O |
Product Overview
Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- (CAS 87701-35-7), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: 1-[4-(2-hydroxypropan-2-yl)phenyl]-3-methylurea.
Chemical Property Profile of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-
Property Insights of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-
The XLogP value of 1.6653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-. Following Lipinski's Rule of Five, Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- has 3 hydrogen bond donor(s) and 2 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 Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-?
The CAS number of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- is 87701-35-7.
What is the molecular formula of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-?
The molecular formula of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- is C11H16N2O2.
What is the molecular weight of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-?
The molecular weight of Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- is 208.12 g/mol.
Where can I buy Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-?
You can request a quote for Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-[4-(1-hydroxy-1-methylethyl)phenyl]-N'-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.