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Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate
TL;DR: Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate (CAS 26321-12-0) is a chemical compound with molecular formula C14H13N3S2 and molecular weight 287.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[[phenyl(pyridin-2-yl)methylidene]amino]carbamodithioate
Also Known As: Methyl (2E)-2-[phenyl(2-pyridinyl)methylene]hydrazinecarbodithioate, methyl 2-[phenyl(pyridin-2-yl)methylidene]hydrazinecarbodithioate, methyl N-[[phenyl(pyridin-2-yl)methylidene]amino]carbamodithioate, Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate
| Molecular Formula | C14H13N3S2 |
|---|---|
| Molecular Weight | 287.06 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 94.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.05508 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 26321-12-0 |
|---|---|
| SMILES | CSC(=S)NN=C(C1=CC=CC=C1)C2=CC=CC=N2 |
| InChIKey | UIILRWXOQVCBIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate (CAS 26321-12-0), with molecular formula C14H13N3S2 and molecular weight 287.06 g/mol. IUPAC: methyl N-[[phenyl(pyridin-2-yl)methylidene]amino]carbamodithioate.
Chemical Property Profile of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate
Property Insights of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate
The XLogP value of 3.9 indicates that Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate. Following Lipinski's Rule of Five, Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate has 1 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 Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate?
The CAS number of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate is 26321-12-0.
What is the molecular formula of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate?
The molecular formula of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate is C14H13N3S2.
What is the molecular weight of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate?
The molecular weight of Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate is 287.06 g/mol.
Where can I buy Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate?
You can request a quote for Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate?
Yes, KEHONG BIO provides custom synthesis services for Methyl hydrogen [phenyl(pyridin-2-yl)methylidene]carbonodithiohydrazonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.