4-N-Prolyl-2-benzoquinone
TL;DR: 4-N-Prolyl-2-benzoquinone (CAS 1440-62-6) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-(3,4-dioxocyclohexa-1,5-dien-1-yl)pyrrolidine-2-carboxylic acid
Also Known As: 4-N-Prolyl-2-benzoquinone, KST-1B0491, N-(1,2-Benzoquinone-4-yl)proline, 1-(3,4-dioxocyclohexa-1,5-dien-1-yl)-l-proline, J1.489.806I
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 1440-62-6 |
|---|---|
| SMILES | C1C[C@H](N(C1)C2=CC(=O)C(=O)C=C2)C(=O)O |
| InChIKey | BGOKIEHCWSCUBQ-QMMMGPOBSA-N |
Product Overview
4-N-Prolyl-2-benzoquinone (CAS 1440-62-6), with molecular formula C11H11NO4 and molecular weight 221.07 g/mol. IUPAC: (2S)-1-(3,4-dioxocyclohexa-1,5-dien-1-yl)pyrrolidine-2-carboxylic acid.
Chemical Property Profile of 4-N-Prolyl-2-benzoquinone
Property Insights of 4-N-Prolyl-2-benzoquinone
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-N-Prolyl-2-benzoquinone. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N-Prolyl-2-benzoquinone. Following Lipinski's Rule of Five, 4-N-Prolyl-2-benzoquinone has 1 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 4-N-Prolyl-2-benzoquinone?
The CAS number of 4-N-Prolyl-2-benzoquinone is 1440-62-6.
What is the molecular formula of 4-N-Prolyl-2-benzoquinone?
The molecular formula of 4-N-Prolyl-2-benzoquinone is C11H11NO4.
What is the molecular weight of 4-N-Prolyl-2-benzoquinone?
The molecular weight of 4-N-Prolyl-2-benzoquinone is 221.07 g/mol.
Where can I buy 4-N-Prolyl-2-benzoquinone?
You can request a quote for 4-N-Prolyl-2-benzoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-N-Prolyl-2-benzoquinone?
Yes, KEHONG BIO provides custom synthesis services for 4-N-Prolyl-2-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.