![1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid structure](/static/products/7318/731802-27-0.webp)
1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid
TL;DR: 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid (CAS 731802-27-0) is a chemical compound with molecular formula C24H23N3O4S and molecular weight 449.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxylic acid
Also Known As: 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid, 1-[1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxylic acid, 1-[1-[4-(6-methylbenzothiazol-2-yl)phenyl]-2,5-dioxo-pyrrolidin-3-yl]piperidine-4-carboxylic Acid, 1-{1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,5-dioxopyrrolidin-3-yl}piperidine-4-carboxylic acid
| Molecular Formula | C24H23N3O4S |
|---|---|
| Molecular Weight | 449.14 g/mol |
| LogP | 3.70022 |
| Topological Polar Surface Area | 90.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.14093 |
| Heavy Atoms | 32 |
| Complexity | 1211.7123 |
Chemical Identifiers
| CAS Number | 731802-27-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)CC(C4=O)N5CCC(CC5)C(=O)O |
Product Overview
1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid (CAS 731802-27-0), with molecular formula C24H23N3O4S and molecular weight 449.14 g/mol. IUPAC: 1-[1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxylic acid.
Chemical Property Profile of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid
Property Insights of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid
The XLogP value of 3.70022 indicates that 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid. Following Lipinski's Rule of Five, 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid has 1 hydrogen bond donor(s) and 6 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 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid?
The CAS number of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid is 731802-27-0.
What is the molecular formula of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid?
The molecular formula of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid is C24H23N3O4S.
What is the molecular weight of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid?
The molecular weight of 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid is 449.14 g/mol.
Where can I buy 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid?
You can request a quote for 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-[4-(6-Methyl-2-benzothiazolyl)phenyl]-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.