RefChem:1088762
TL;DR: RefChem:1088762 (CAS 101756-24-5) is a chemical compound with molecular formula C23H36ClN3O4 and molecular weight 453.23944 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl 2-[2-(3-methyl-1-phenyl-1,8-diaza-3-azoniaspiro[4.5]decan-8-yl)ethyl]propanedioate chloride
Also Known As: 8-(3,3-Bis(ethoxycarbonyl)propyl)-3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4,5)decane HCl, Malonic acid, (2-(3-methyl-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)ethyl)-, diethyl ester, hydrochloride, DIETHYL2-[2-(3-METHYL-1-PHENYL-1,8-DIAZA-3-AZONIASPIRO[4.5]DECAN-8-YL)ETHYL]PROPANEDIOATE CHLORIDE, diethyl2-[2-(3-methyl-1-phenyl-1,8-diaza-3-azoniaspiro[4.5]decan-8-yl)ethyl]propanedioate, MALONIC ACID, (2-(3-METHYL-1-PHENYL-1,3,8-TRIAZASPIRO(4.5)DEC-8-YL)ETHYL)-, DIET
Technical Specifications
| Molecular Formula | C23H36ClN3O4 |
| Molecular Weight | 453.23944 g/mol |
| XLogP | -2.05 |
| Topological Polar Surface Area (TPSA) | 63.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 453.23944 Da |
| Heavy Atoms | 31 |
| Complexity | 553.0 |
| SMILES | CCOC(=O)C(CCN1CCC2(CC1)C[NH+](CN2C3=CC=CC=C3)C)C(=O)OCC.[Cl-] |
| InChIKey | NOJLQGVHODOWHL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1088762
Property Insights of RefChem:1088762
The XLogP value of -2.05 indicates that RefChem:1088762 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1088762. Following Lipinski's Rule of Five, RefChem:1088762 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1088762?
The CAS number of RefChem:1088762 is 101756-24-5.
What is the molecular formula of RefChem:1088762?
The molecular formula of RefChem:1088762 is C23H36ClN3O4.
What is the molecular weight of RefChem:1088762?
The molecular weight of RefChem:1088762 is 453.23944 g/mol.
Where can I buy RefChem:1088762?
You can request a quote for RefChem:1088762 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1088762?
Yes, CoreyChem provides custom synthesis services for RefChem:1088762 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.