4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate
TL;DR: 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate (CAS 303087-31-2) is a chemical compound with molecular formula C22H16BrClN2O4 and molecular weight 486.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3-bromobenzoate
Also Known As: A1113/0052314, 4-(2-((4-CHLOROPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE, 4-[(E)-{[2-(4-CHLOROPHENOXY)ACETAMIDO]IMINO}METHYL]PHENYL 3-BROMOBENZOATE, 658-139-3, RefChem:511230
| Molecular Formula | C22H16BrClN2O4 |
|---|---|
| Molecular Weight | 486.00 g/mol |
| LogP | 4.8508 |
| Topological Polar Surface Area | 76.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.9982 |
| Heavy Atoms | 30 |
| Complexity | 1053.4926 |
Chemical Identifiers
| CAS Number | 303087-31-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)COC3=CC=C(C=C3)Cl |
Product Overview
4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate (CAS 303087-31-2), with molecular formula C22H16BrClN2O4 and molecular weight 486.00 g/mol. IUPAC: [4-[(E)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3-bromobenzoate.
Chemical Property Profile of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate
Property Insights of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate
The XLogP value of 4.8508 indicates that 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate. Following Lipinski's Rule of Five, 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate has 1 hydrogen bond donor(s) and 5 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 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate?
The CAS number of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate is 303087-31-2.
What is the molecular formula of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate?
The molecular formula of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate is C22H16BrClN2O4.
What is the molecular weight of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate?
The molecular weight of 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate is 486.00 g/mol.
Where can I buy 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate?
You can request a quote for 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-((4-Chlorophenoxy)acetyl)carbohydrazonoyl)phenyl 3-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.