2-(Ethoxycarbonyl)-5-oxo-3-phenylproline
TL;DR: 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline (CAS 31167-97-2) is a chemical compound with molecular formula C14H15NO5 and molecular weight 277.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxycarbonyl-5-oxo-3-phenylpyrrolidine-2-carboxylic acid
Also Known As: ChemDiv2_000468, 2-(ethoxycarbonyl)-5-oxo-3-phenylproline, BIM-0001788.P001, 2-(ethoxycarbonyl)-5-oxo-3-phenylpyrrolidine-2-carboxylic acid, 2-ethoxycarbonyl-5-oxo-3-phenylpyrrolidine-2-carboxylic acid
| Molecular Formula | C14H15NO5 |
|---|---|
| Molecular Weight | 277.10 g/mol |
| LogP | 0.6766 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.09503 |
| Heavy Atoms | 20 |
| Complexity | 541.75507 |
Chemical Identifiers
| CAS Number | 31167-97-2 |
|---|---|
| SMILES | CCOC(=O)C1(C(CC(=O)N1)C2=CC=CC=C2)C(=O)O |
Product Overview
2-(Ethoxycarbonyl)-5-oxo-3-phenylproline (CAS 31167-97-2), with molecular formula C14H15NO5 and molecular weight 277.10 g/mol. IUPAC: 2-ethoxycarbonyl-5-oxo-3-phenylpyrrolidine-2-carboxylic acid.
Chemical Property Profile of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline
Property Insights of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline
The XLogP value of 0.6766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline. Following Lipinski's Rule of Five, 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline has 2 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-(Ethoxycarbonyl)-5-oxo-3-phenylproline?
The CAS number of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline is 31167-97-2.
What is the molecular formula of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline?
The molecular formula of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline is C14H15NO5.
What is the molecular weight of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline?
The molecular weight of 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline is 277.10 g/mol.
Where can I buy 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline?
You can request a quote for 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethoxycarbonyl)-5-oxo-3-phenylproline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.