(E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea
TL;DR: (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea (CAS 69737-08-2) is a chemical compound with molecular formula C12H16ClN3O2 and molecular weight 269.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[(3E)-3-hydroxyimino-2-methylbutan-2-yl]urea
Also Known As: (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea
| Molecular Formula | C12H16ClN3O2 |
|---|---|
| Molecular Weight | 269.09 g/mol |
| LogP | 3.0902 |
| Topological Polar Surface Area | 73.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.0931 |
| Heavy Atoms | 18 |
| Complexity | 454.89526 |
Chemical Identifiers
| CAS Number | 69737-08-2 |
|---|---|
| SMILES | C/C(=N\O)/C(C)(C)NC(=O)NC1=CC=C(C=C1)Cl |
Product Overview
(E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea (CAS 69737-08-2), with molecular formula C12H16ClN3O2 and molecular weight 269.09 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[(3E)-3-hydroxyimino-2-methylbutan-2-yl]urea.
Chemical Property Profile of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea
Property Insights of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea
The XLogP value of 3.0902 indicates that (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea. Following Lipinski's Rule of Five, (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea has 3 hydrogen bond donor(s) and 3 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 (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea?
The CAS number of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea is 69737-08-2.
What is the molecular formula of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea?
The molecular formula of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea is C12H16ClN3O2.
What is the molecular weight of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea?
The molecular weight of (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea is 269.09 g/mol.
Where can I buy (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea?
You can request a quote for (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(4-chlorophenyl)-3-(3-(hydroxyimino)-2-methylbutan-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.