![1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester structure](/static/products/833/833433-76-4.png)
1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester
TL;DR: 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester (CAS 833433-76-4) is a chemical compound with molecular formula C17H17NO5 and molecular weight 315.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(2-oxochromene-3-carbonyl)piperidine-4-carboxylate
Also Known As: VU0159122-3, methyl 1-(2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate, methyl 1-(2-oxochromene-3-carbonyl)piperidine-4-carboxylate, F3055-0141, 1-[oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester
| Molecular Formula | C17H17NO5 |
|---|---|
| Molecular Weight | 315.11 g/mol |
| LogP | 1.8182 |
| Topological Polar Surface Area | 76.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.1107 |
| Heavy Atoms | 23 |
| Complexity | 801.9811 |
Chemical Identifiers
| CAS Number | 833433-76-4 |
|---|---|
| SMILES | COC(=O)C1CCN(CC1)C(=O)C2=CC3=CC=CC=C3OC2=O |
Product Overview
1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester (CAS 833433-76-4), with molecular formula C17H17NO5 and molecular weight 315.11 g/mol. IUPAC: methyl 1-(2-oxochromene-3-carbonyl)piperidine-4-carboxylate.
Chemical Property Profile of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester
Property Insights of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester
The XLogP value of 1.8182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester. The TPSA of 76.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester. Following Lipinski's Rule of Five, 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester has 0 hydrogen bond donor(s) and 5 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-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester?
The CAS number of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester is 833433-76-4.
What is the molecular formula of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester?
The molecular formula of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester is C17H17NO5.
What is the molecular weight of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester?
The molecular weight of 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester is 315.11 g/mol.
Where can I buy 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester?
You can request a quote for 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-[Oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.