(4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone
TL;DR: (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone (CAS 898526-62-0) is a chemical compound with molecular formula C16H19N3OS and molecular weight 301.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperidin-1-yl)-(4-methylthiadiazol-5-yl)methanone
Also Known As: (4-benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone, AS-871/43478336, 4-methyl(1,2,3-thiadiazol-5-yl) 4-benzylpiperidyl ketone, (4-benzylpiperidin-1-yl)-(4-methylthiadiazol-5-yl)methanone, 4-benzyl-1-[(4-methyl-1,2,3-thiadiazol-5-yl)carbonyl]piperidine
| Molecular Formula | C16H19N3OS |
|---|---|
| Molecular Weight | 301.12 g/mol |
| LogP | 2.94142 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.12488 |
| Heavy Atoms | 21 |
| Complexity | 602.99445 |
Chemical Identifiers
| CAS Number | 898526-62-0 |
|---|---|
| SMILES | CC1=C(SN=N1)C(=O)N2CCC(CC2)CC3=CC=CC=C3 |
Product Overview
(4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone (CAS 898526-62-0), with molecular formula C16H19N3OS and molecular weight 301.12 g/mol. IUPAC: (4-benzylpiperidin-1-yl)-(4-methylthiadiazol-5-yl)methanone.
Chemical Property Profile of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone
Property Insights of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone
The XLogP value of 2.94142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone. With a topological polar surface area (TPSA) of 46.09 Ų, (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone has 0 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 (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone?
The CAS number of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone is 898526-62-0.
What is the molecular formula of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone?
The molecular formula of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone is C16H19N3OS.
What is the molecular weight of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone?
The molecular weight of (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone is 301.12 g/mol.
Where can I buy (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone?
You can request a quote for (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Benzylpiperidin-1-yl)(4-methyl-1,2,3-thiadiazol-5-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.