Carbamic acid, piperidinomethyl ester
TL;DR: Carbamic acid, piperidinomethyl ester (CAS 97782-08-6) is a chemical compound with molecular formula C9H18N2S2 and molecular weight 218.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
piperidin-1-ylmethyl N,N-dimethylcarbamodithioate
Also Known As: Carbamic acid, piperidinomethyl ester, piperidin-1-ylmethyl dimethylcarbamodithioate, (Piperidin-1-yl)methyl dimethylcarbamodithioate, piperidin-1-ylmethyl N,N-dimethylcarbamodithioate, Piperidine, 1-[[(dimethylamino)thioxomethyl]thio]methyl-
| Molecular Formula | C9H18N2S2 |
|---|---|
| Molecular Weight | 218.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 63.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.09114 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 97782-08-6 |
|---|---|
| SMILES | CN(C)C(=S)SCN1CCCCC1 |
| InChIKey | ISLFJOPPIKIHHW-UHFFFAOYSA-N |
Product Overview
Carbamic acid, piperidinomethyl ester (CAS 97782-08-6), with molecular formula C9H18N2S2 and molecular weight 218.09 g/mol. IUPAC: piperidin-1-ylmethyl N,N-dimethylcarbamodithioate.
Chemical Property Profile of Carbamic acid, piperidinomethyl ester
Property Insights of Carbamic acid, piperidinomethyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, piperidinomethyl ester. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, piperidinomethyl ester. Following Lipinski's Rule of Five, Carbamic acid, piperidinomethyl ester has 0 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 Carbamic acid, piperidinomethyl ester?
The CAS number of Carbamic acid, piperidinomethyl ester is 97782-08-6.
What is the molecular formula of Carbamic acid, piperidinomethyl ester?
The molecular formula of Carbamic acid, piperidinomethyl ester is C9H18N2S2.
What is the molecular weight of Carbamic acid, piperidinomethyl ester?
The molecular weight of Carbamic acid, piperidinomethyl ester is 218.09 g/mol.
Where can I buy Carbamic acid, piperidinomethyl ester?
You can request a quote for Carbamic acid, piperidinomethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, piperidinomethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, piperidinomethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.