![2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole structure](/static/products/874/874791-25-0.png)
2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole
TL;DR: 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole (CAS 874791-25-0) is a chemical compound with molecular formula C20H20N2O2S and molecular weight 352.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methoxyphenyl)methanone
Also Known As: US11116757, No. D14, 2-[1-(3-methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole, AB00765928-01, 4-benzothiazol-2-ylpiperidyl 3-methoxyphenyl ketone, D345-0324
| Molecular Formula | C20H20N2O2S |
|---|---|
| Molecular Weight | 352.12 g/mol |
| LogP | 4.3247 |
| Topological Polar Surface Area | 42.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.12454 |
| Heavy Atoms | 25 |
| Complexity | 864.35736 |
Chemical Identifiers
| CAS Number | 874791-25-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3 |
Product Overview
2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole (CAS 874791-25-0), with molecular formula C20H20N2O2S and molecular weight 352.12 g/mol. IUPAC: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methoxyphenyl)methanone.
Chemical Property Profile of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole
Property Insights of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole
The XLogP value of 4.3247 indicates that 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.43 Ų, 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole 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 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole?
The CAS number of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole is 874791-25-0.
What is the molecular formula of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole?
The molecular formula of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole is C20H20N2O2S.
What is the molecular weight of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole?
The molecular weight of 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole is 352.12 g/mol.
Where can I buy 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole?
You can request a quote for 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(3-Methoxybenzoyl)piperidin-4-yl]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.