N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide
TL;DR: N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide (CAS 142564-97-4) is a chemical compound with molecular formula C11H15N5S and molecular weight 249.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide
Also Known As: Pentanamide,2-ethyl-4-methyl-3-oxo, acetylpyrazine N-pyrrolidinylthiosemicarbazone, N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide, N-(1-pyrazin-2-ylethylideneamino)pyrrolidine-1-carbothioamide, Pyrrolidine-1-thiocarboxylic acid 2-[1-[2-pyrazinyl[ethylidene]hydrazide
| Molecular Formula | C11H15N5S |
|---|---|
| Molecular Weight | 249.10 g/mol |
| LogP | 1.1709 |
| Topological Polar Surface Area | 53.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.10481 |
| Heavy Atoms | 17 |
| Complexity | 411.1298 |
Chemical Identifiers
| CAS Number | 142564-97-4 |
|---|---|
| SMILES | C/C(=N\NC(=S)N1CCCC1)/C2=NC=CN=C2 |
Product Overview
N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide (CAS 142564-97-4), with molecular formula C11H15N5S and molecular weight 249.10 g/mol. IUPAC: N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide.
Chemical Property Profile of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide
Property Insights of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide
The XLogP value of 1.1709 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide. With a topological polar surface area (TPSA) of 53.41 Ų, N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide 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 N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide?
The CAS number of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide is 142564-97-4.
What is the molecular formula of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide?
The molecular formula of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide is C11H15N5S.
What is the molecular weight of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide?
The molecular weight of N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide is 249.10 g/mol.
Where can I buy N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide?
You can request a quote for N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-1-pyrazin-2-ylethylideneamino]pyrrolidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.