RefChem:319204
TL;DR: RefChem:319204 (CAS 66902-90-7) is a chemical compound with molecular formula C25H37NO7S and molecular weight 495.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[3-(2-hydroxy-2,2-diphenylacetyl)oxy-2,2-dimethylpropyl]-methylazanium;methyl sulfate
Also Known As: Ammonium, diethyl(2,2-dimethyl-3-hydroxypropyl)methyl-, methyl sulfate, benzilate (ester), Benzilsaeure-(3-methyldiaethylammonium-2,2-dimethyl-1-propanol)-ester-methylsulfat [German], Benzilsaeure-(3-methyldiaethylammonium-2,2-dimethyl-1-propanol)-ester-methylsulfat, diethyl-[3-(2-hydroxy-2,2-diphenylacetyl)oxy-2,2-dimethylpropyl]-methylazanium; methyl sulfate, AMMONIUM, DIETHYL(2,2-DIMETHYL-3-HYDROXYPROPYL)METHYL-, METHYL SULFATE, BENZILAT
| Molecular Formula | C25H37NO7S |
|---|---|
| Molecular Weight | 495.23 g/mol |
| LogP | 3.07 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 495.22906 |
| Heavy Atoms | 34 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 66902-90-7 |
|---|---|
| SMILES | CC[N+](C)(CC)CC(C)(C)COC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.COS(=O)(=O)[O-] |
| InChIKey | SLNFUCLHNSAKRK-UHFFFAOYSA-M |
Product Overview
RefChem:319204 (CAS 66902-90-7), with molecular formula C25H37NO7S and molecular weight 495.23 g/mol. IUPAC: diethyl-[3-(2-hydroxy-2,2-diphenylacetyl)oxy-2,2-dimethylpropyl]-methylazanium;methyl sulfate.
Chemical Property Profile of RefChem:319204
Property Insights of RefChem:319204
The XLogP value of 3.07 indicates that RefChem:319204 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:319204. Following Lipinski's Rule of Five, RefChem:319204 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
Frequently Asked Questions
What is the CAS number of RefChem:319204?
The CAS number of RefChem:319204 is 66902-90-7.
What is the molecular formula of RefChem:319204?
The molecular formula of RefChem:319204 is C25H37NO7S.
What is the molecular weight of RefChem:319204?
The molecular weight of RefChem:319204 is 495.23 g/mol.
Where can I buy RefChem:319204?
You can request a quote for RefChem:319204 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319204?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319204 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.