![methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate structure](/static/products/1450/1450713-57-1.webp)
methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate
TL;DR: methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate (CAS 1450713-57-1) is a chemical compound with molecular formula C8H9N3S2 and molecular weight 211.02379 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate
Also Known As: methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate, (E)-{[(methylsulfanyl)methanethioyl]amino}[(pyridin-4-yl)methylidene]amine
Technical Specifications
| Molecular Formula | C8H9N3S2 |
| Molecular Weight | 211.02379 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 94.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.02379 Da |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
| SMILES | CSC(=S)N/N=C\C1=CC=NC=C1 |
| InChIKey | IKXIXCRRDKIJLW-POHAHGRESA-N |
Chemical Property Profile of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate
Property Insights of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate. Following Lipinski's Rule of Five, methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate 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
What is the CAS number of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate?
The CAS number of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate is 1450713-57-1.
What is the molecular formula of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate?
The molecular formula of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate is C8H9N3S2.
What is the molecular weight of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate?
The molecular weight of methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate is 211.02379 g/mol.
Where can I buy methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate?
You can request a quote for methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate?
Yes, CoreyChem provides custom synthesis services for methyl N-[(Z)-pyridin-4-ylmethylideneamino]carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.