4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate
TL;DR: 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate (CAS 769150-28-9) is a chemical compound with molecular formula C23H20BrN3O4S and molecular weight 513.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-bromo-2-[(E)-[(4-methoxyphenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-methoxybenzoate
Also Known As: 4-BR-2-(2-((4-METHOXYANILINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PH 4-METHOXYBENZOATE, [4-bromo-2-[[(4-methoxyphenyl)thiocarbamoylhydrazinylidene]methyl]phenyl] 4-methoxybenzoate, 643-762-5, RefChem:518727
| Molecular Formula | C23H20BrN3O4S |
|---|---|
| Molecular Weight | 513.04 g/mol |
| LogP | 5.006 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.03577 |
| Heavy Atoms | 32 |
| Complexity | 1119.0903 |
Chemical Identifiers
| CAS Number | 769150-28-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=S)NC3=CC=C(C=C3)OC |
Product Overview
4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate (CAS 769150-28-9), with molecular formula C23H20BrN3O4S and molecular weight 513.04 g/mol. IUPAC: [4-bromo-2-[(E)-[(4-methoxyphenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-methoxybenzoate.
Chemical Property Profile of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate
Property Insights of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate
The XLogP value of 5.006 indicates that 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate. Following Lipinski's Rule of Five, 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate?
The CAS number of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate is 769150-28-9.
What is the molecular formula of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate?
The molecular formula of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate is C23H20BrN3O4S.
What is the molecular weight of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate?
The molecular weight of 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate is 513.04 g/mol.
Where can I buy 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate?
You can request a quote for 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-BR-2-(2-((4-Methoxyanilino)carbothioyl)carbohydrazonoyl)PH 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.