RefChem:261330
TL;DR: RefChem:261330 (CAS 3209-86-7) is a chemical compound with molecular formula C24H31NO7 and molecular weight 445.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;2-hydroxy-2-oxoacetate
Also Known As: alpha-(1-Naphthylmethyl)tetrahydro-2-furanpropionic acid 2-(dimethylamino)ethyl ester oxalate, 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-(dimethylamino)ethyl ester, oxalate (1:1), dimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-hydroxy-2-oxoacetate, N,N-Dimethyl-2-((3-(naphthalen-1-yl)-2-((tetrahydrofuran-2-yl)methyl)propanoyl)oxy)ethanaminium carboxyformate, 2-FURANPROPIONIC ACID, TETRAHYDRO-alpha-(1-NAPHTHYLMETHYL)-, 2-(DIMETHYLAMINO)ET
| Molecular Formula | C24H31NO7 |
|---|---|
| Molecular Weight | 445.21 g/mol |
| LogP | 0.08 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 445.21005 |
| Heavy Atoms | 32 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 3209-86-7 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)[O-])O |
| InChIKey | AKFQENNFMKAKGN-UHFFFAOYSA-N |
Product Overview
RefChem:261330 (CAS 3209-86-7), with molecular formula C24H31NO7 and molecular weight 445.21 g/mol. IUPAC: dimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;2-hydroxy-2-oxoacetate.
Chemical Property Profile of RefChem:261330
Property Insights of RefChem:261330
The XLogP value of 0.08 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:261330. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:261330. Following Lipinski's Rule of Five, RefChem:261330 has 2 hydrogen bond donor(s) and 7 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 RefChem:261330?
The CAS number of RefChem:261330 is 3209-86-7.
What is the molecular formula of RefChem:261330?
The molecular formula of RefChem:261330 is C24H31NO7.
What is the molecular weight of RefChem:261330?
The molecular weight of RefChem:261330 is 445.21 g/mol.
Where can I buy RefChem:261330?
You can request a quote for RefChem:261330 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:261330?
Yes, KEHONG BIO provides custom synthesis services for RefChem:261330 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.