![[4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate structure](/static/products/7691/769146-36-3.webp)
[4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate
TL;DR: [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate (CAS 769146-36-3) is a chemical compound with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate
Also Known As: 4-(2-(anilinocarbothioyl)carbohydrazonoyl)phenyl 2-methylbenzoate, [4-[(phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate, [4-[(phenylthiocarbamoylhydrazinylidene)methyl]phenyl] 2-methylbenzoate
| Molecular Formula | C22H19N3O2S |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 4.53472 |
| Topological Polar Surface Area | 62.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.1198 |
| Heavy Atoms | 28 |
| Complexity | 986.1784 |
Chemical Identifiers
| CAS Number | 769146-36-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C=NNC(=S)NC3=CC=CC=C3 |
Product Overview
[4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate (CAS 769146-36-3), with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol. IUPAC: [4-[(phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate.
Chemical Property Profile of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate
Property Insights of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate
The XLogP value of 4.53472 indicates that [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.72 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate. Following Lipinski's Rule of Five, [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate has 2 hydrogen bond donor(s) and 4 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-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate?
The CAS number of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate is 769146-36-3.
What is the molecular formula of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate?
The molecular formula of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate is C22H19N3O2S.
What is the molecular weight of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate?
The molecular weight of [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate is 389.12 g/mol.
Where can I buy [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate?
You can request a quote for [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-[(Phenylcarbamothioylhydrazinylidene)methyl]phenyl] 2-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.