![Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- structure](/static/products/6942/6942-52-5.webp)
Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-
TL;DR: Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- (CAS 6942-52-5) is a chemical compound with molecular formula C21H33N3O2S and molecular weight 391.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(dodecylcarbamothioylhydrazinylidene)methyl]benzoic acid
Also Known As: NCIOpen2_007471, 2-[(dodecylcarbamothioylhydrazinylidene)methyl]benzoic acid, 2-[(E)-(dodecylcarbamothioylhydrazinylidene)methyl]benzoic a, Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-
| Molecular Formula | C21H33N3O2S |
|---|---|
| Molecular Weight | 391.23 g/mol |
| LogP | 5.1037 |
| Topological Polar Surface Area | 73.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 391.22934 |
| Heavy Atoms | 27 |
| Complexity | 590.5444 |
Chemical Identifiers
| CAS Number | 6942-52-5 |
|---|---|
| SMILES | CCCCCCCCCCCCNC(=S)NN=CC1=CC=CC=C1C(=O)O |
Product Overview
Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- (CAS 6942-52-5), with molecular formula C21H33N3O2S and molecular weight 391.23 g/mol. IUPAC: 2-[(dodecylcarbamothioylhydrazinylidene)methyl]benzoic acid.
Chemical Property Profile of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-
Property Insights of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-
The XLogP value of 5.1037 indicates that Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- 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 Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-. Following Lipinski's Rule of Five, Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-?
The CAS number of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- is 6942-52-5.
What is the molecular formula of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-?
The molecular formula of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- is C21H33N3O2S.
What is the molecular weight of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-?
The molecular weight of Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- is 391.23 g/mol.
Where can I buy Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-?
You can request a quote for Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid,2-[[2-[(dodecylamino)thioxomethyl]hydrazinylidene]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.