![N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide structure](/static/products/907/907549-72-8.png)
N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide
TL;DR: N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide (CAS 907549-72-8) is a chemical compound with molecular formula C12H16N4S and molecular weight 248.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-methyl-2-pyridinyl)methylideneamino]pyrrolidine-1-carbothioamide
Also Known As: NCI60_021431, N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide, 1-Pyrrolidinecarbothioic acid, [(6-methyl-2-pyridinyl)methylene]hydrazide, N-(6-methylpyridin-2-yl)methylideneaminopyrrolidine-1-carbothioamide?907549-72-8
| Molecular Formula | C12H16N4S |
|---|---|
| Molecular Weight | 248.11 g/mol |
| LogP | 1.69422 |
| Topological Polar Surface Area | 40.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.10957 |
| Heavy Atoms | 17 |
| Complexity | 424.26874 |
Chemical Identifiers
| CAS Number | 907549-72-8 |
|---|---|
| SMILES | CC1=NC(=CC=C1)C=NNC(=S)N2CCCC2 |
Product Overview
N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide (CAS 907549-72-8), with molecular formula C12H16N4S and molecular weight 248.11 g/mol. IUPAC: N-[(6-methyl-2-pyridinyl)methylideneamino]pyrrolidine-1-carbothioamide.
Chemical Property Profile of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide
Property Insights of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide
The XLogP value of 1.69422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide. With a topological polar surface area (TPSA) of 40.52 Ų, N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide 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 N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide?
The CAS number of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide is 907549-72-8.
What is the molecular formula of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide?
The molecular formula of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide is C12H16N4S.
What is the molecular weight of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide?
The molecular weight of N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide is 248.11 g/mol.
Where can I buy N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide?
You can request a quote for N-[(6-methylpyridin-2-yl)methylideneamino]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-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-methylpyridin-2-yl)methylideneamino]pyrrolidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.