RefChem:316383
TL;DR: RefChem:316383 (CAS 66859-41-4) is a chemical compound with molecular formula C23H31NO7S and molecular weight 465.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) 2,2-diphenylacetate;hydrogen sulfate
Also Known As: C23H29.1/2H2O4S, C23-H29.1/2H2-O4-S, Acetic acid, 2,2-diphenyl-, (2,2-dimethyl-3-morpholinopropyl) ester, hydrogen sulfate (2:1), 2,2-Diphenylacetic acid (2,2-dimethyl-3-morpholinopropyl) ester hydrogen sulfate (2:1), (2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) 2,2-diphenylacetate; hydrogen sulfate
| Molecular Formula | C23H31NO7S |
|---|---|
| Molecular Weight | 465.18 g/mol |
| LogP | 1.31 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.18213 |
| Heavy Atoms | 32 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 66859-41-4 |
|---|---|
| SMILES | CC(C)(C[NH+]1CCOCC1)COC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.OS(=O)(=O)[O-] |
| InChIKey | NBJMTXCDGZJUPX-UHFFFAOYSA-N |
Product Overview
RefChem:316383 (CAS 66859-41-4), with molecular formula C23H31NO7S and molecular weight 465.18 g/mol. IUPAC: (2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) 2,2-diphenylacetate;hydrogen sulfate.
Chemical Property Profile of RefChem:316383
Property Insights of RefChem:316383
The XLogP value of 1.31 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:316383. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:316383. Following Lipinski's Rule of Five, RefChem:316383 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:316383?
The CAS number of RefChem:316383 is 66859-41-4.
What is the molecular formula of RefChem:316383?
The molecular formula of RefChem:316383 is C23H31NO7S.
What is the molecular weight of RefChem:316383?
The molecular weight of RefChem:316383 is 465.18 g/mol.
Where can I buy RefChem:316383?
You can request a quote for RefChem:316383 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316383?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316383 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.