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Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate
TL;DR: Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate (CAS 142564-59-8) is a chemical compound with molecular formula C8H10N4S2 and molecular weight 226.03468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-[(E)-1-pyrimidin-4-ylethylideneamino]carbamodithioate
Also Known As: AE-420/30083001, methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate
Technical Specifications
| Molecular Formula | C8H10N4S2 |
| Molecular Weight | 226.03468 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.03468 Da |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
| SMILES | C/C(=N\NC(=S)SC)/C1=NC=NC=C1 |
| InChIKey | CAMQKXPJYNDSPV-IZZDOVSWSA-N |
Chemical Property Profile of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate
Property Insights of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate. Following Lipinski's Rule of Five, Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate 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
What is the CAS number of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate?
The CAS number of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate is 142564-59-8.
What is the molecular formula of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate?
The molecular formula of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate is C8H10N4S2.
What is the molecular weight of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate?
The molecular weight of Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate is 226.03468 g/mol.
Where can I buy Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate?
You can request a quote for Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-[1-(4-pyrimidinyl)ethylidene]hydrazinecarbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.