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Piperidine, 1-[(methylamino)thioxomethoxy]-
TL;DR: Piperidine, 1-[(methylamino)thioxomethoxy]- (CAS 21094-45-1) is a chemical compound with molecular formula C7H14N2OS and molecular weight 174.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-piperidin-1-yl N-methylcarbamothioate
Also Known As: O-piperidin-1-yl N-methylcarbamothioate, O-piperidin-1-yl methylcarbamothioate, O-(Piperidin-1-yl) methylcarbamothioate, Piperidine, 1-[(methylamino)thioxomethoxy]-, N-METHYL-1-(PIPERIDIN-1-YLOXY)METHANETHIOAMIDE
| Molecular Formula | C7H14N2OS |
|---|---|
| Molecular Weight | 174.08 g/mol |
| LogP | 0.9082 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.08269 |
| Heavy Atoms | 11 |
| Complexity | 134.40227 |
Chemical Identifiers
| CAS Number | 21094-45-1 |
|---|---|
| SMILES | CNC(=S)ON1CCCCC1 |
Product Overview
Piperidine, 1-[(methylamino)thioxomethoxy]- (CAS 21094-45-1), with molecular formula C7H14N2OS and molecular weight 174.08 g/mol. IUPAC: O-piperidin-1-yl N-methylcarbamothioate.
Chemical Property Profile of Piperidine, 1-[(methylamino)thioxomethoxy]-
Property Insights of Piperidine, 1-[(methylamino)thioxomethoxy]-
The XLogP value of 0.9082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidine, 1-[(methylamino)thioxomethoxy]-. With a topological polar surface area (TPSA) of 24.5 Ų, Piperidine, 1-[(methylamino)thioxomethoxy]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidine, 1-[(methylamino)thioxomethoxy]- 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 Piperidine, 1-[(methylamino)thioxomethoxy]-?
The CAS number of Piperidine, 1-[(methylamino)thioxomethoxy]- is 21094-45-1.
What is the molecular formula of Piperidine, 1-[(methylamino)thioxomethoxy]-?
The molecular formula of Piperidine, 1-[(methylamino)thioxomethoxy]- is C7H14N2OS.
What is the molecular weight of Piperidine, 1-[(methylamino)thioxomethoxy]-?
The molecular weight of Piperidine, 1-[(methylamino)thioxomethoxy]- is 174.08 g/mol.
Where can I buy Piperidine, 1-[(methylamino)thioxomethoxy]-?
You can request a quote for Piperidine, 1-[(methylamino)thioxomethoxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 1-[(methylamino)thioxomethoxy]-?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 1-[(methylamino)thioxomethoxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.