Nectrisine
TL;DR: Nectrisine (CAS 108692-47-3) is a chemical compound with molecular formula C5H9NO3 and molecular weight 131.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S)-2-(hydroxymethyl)-3,4-dihydro-2H-pyrrole-3,4-diol
Also Known As: Nectrisine, 2H-Pyrrole-3,4-diol, WF 4490, (2R,3R,4S)-2-(hydroxymethyl)-3,4-dihydro-2H-pyrrole-3,4-diol, 3,4-dihydroxy-2-(hydroxymethyl)pyrrolidine
| Molecular Formula | C5H9NO3 |
|---|---|
| Molecular Weight | 131.06 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.05824 |
| Heavy Atoms | 9 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 108692-47-3 |
|---|---|
| SMILES | C1=N[C@@H]([C@H]([C@H]1O)O)CO |
| InChIKey | QUPCOXZVKXONSC-MROZADKFSA-N |
Product Overview
Nectrisine (CAS 108692-47-3), with molecular formula C5H9NO3 and molecular weight 131.06 g/mol. IUPAC: (2R,3R,4S)-2-(hydroxymethyl)-3,4-dihydro-2H-pyrrole-3,4-diol.
Chemical Property Profile of Nectrisine
Property Insights of Nectrisine
The XLogP value of -1.9 indicates that Nectrisine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Nectrisine. Following Lipinski's Rule of Five, Nectrisine has 3 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 Nectrisine?
The CAS number of Nectrisine is 108692-47-3.
What is the molecular formula of Nectrisine?
The molecular formula of Nectrisine is C5H9NO3.
What is the molecular weight of Nectrisine?
The molecular weight of Nectrisine is 131.06 g/mol.
Where can I buy Nectrisine?
You can request a quote for Nectrisine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nectrisine?
Yes, KEHONG BIO provides custom synthesis services for Nectrisine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.