1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide
TL;DR: 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide (CAS 16552-99-1) is a chemical compound with molecular formula C11H14N4S and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-pyridin-2-ylmethylideneamino]pyrrolidine-1-carbothioamide
Also Known As: Cid 9577310, 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide, 1-Pyrrolidinecarbothioic acid, (2-pyridylmethylene)hydrazide, 1-Pyrrolidinecarbothioic acid, (2-pyridinylmethylene)hydrazide, N-[(E)-pyridin-2-ylmethylideneamino]pyrrolidine-1-carbothioamide
| Molecular Formula | C11H14N4S |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 1.3858 |
| Topological Polar Surface Area | 40.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.09392 |
| Heavy Atoms | 16 |
| Complexity | 370.83078 |
Chemical Identifiers
| CAS Number | 16552-99-1 |
|---|---|
| SMILES | C1CCN(C1)C(=S)N/N=C/C2=CC=CC=N2 |
Product Overview
1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide (CAS 16552-99-1), with molecular formula C11H14N4S and molecular weight 234.09 g/mol. IUPAC: N-[(E)-pyridin-2-ylmethylideneamino]pyrrolidine-1-carbothioamide.
Chemical Property Profile of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide
Property Insights of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide
The XLogP value of 1.3858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide. With a topological polar surface area (TPSA) of 40.52 Ų, 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide has 1 hydrogen bond donor(s) and 3 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 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide?
The CAS number of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide is 16552-99-1.
What is the molecular formula of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide?
The molecular formula of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide is C11H14N4S.
What is the molecular weight of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide?
The molecular weight of 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide is 234.09 g/mol.
Where can I buy 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide?
You can request a quote for 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinecarbothioic acid (2-pyridylmethylene) hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.