RefChem:1078312
TL;DR: RefChem:1078312 (CAS 3142-05-0) is a chemical compound with molecular formula C23H32ClNO3 and molecular weight 405.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-[2-(2-methylbutoxy)-2,2-diphenylacetyl]oxyethyl]azanium chloride
Also Known As: X-70, Acetic acid, 2,2-diphenyl-2-(2-methylbutoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride, 2,2-Diphenyl-2-(2-methylbutoxy)acetic acid 2-(dimethylamino)ethyl ester hydrochloride, DIMETHYL-[2-[2-(2-METHYLBUTOXY)-2,2-DIPHENYLACETYL]OXYETHYL]AZANIUMCHLORIDE, dimethyl-[2-[2-(2-methylbutoxy)-2,2-diphenylacetyl]oxyethyl]azanium chloride
| Molecular Formula | C23H32ClNO3 |
|---|---|
| Molecular Weight | 405.21 g/mol |
| LogP | -0.32 |
| Topological Polar Surface Area | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 405.20706 |
| Heavy Atoms | 28 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 3142-05-0 |
|---|---|
| SMILES | CCC(C)COC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC[NH+](C)C.[Cl-] |
| InChIKey | UIXYZMPNPIINNC-UHFFFAOYSA-N |
Product Overview
RefChem:1078312 (CAS 3142-05-0), with molecular formula C23H32ClNO3 and molecular weight 405.21 g/mol. IUPAC: dimethyl-[2-[2-(2-methylbutoxy)-2,2-diphenylacetyl]oxyethyl]azanium chloride.
Chemical Property Profile of RefChem:1078312
Property Insights of RefChem:1078312
The XLogP value of -0.32 indicates that RefChem:1078312 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.0 Ų, RefChem:1078312 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1078312 has 1 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 RefChem:1078312?
The CAS number of RefChem:1078312 is 3142-05-0.
What is the molecular formula of RefChem:1078312?
The molecular formula of RefChem:1078312 is C23H32ClNO3.
What is the molecular weight of RefChem:1078312?
The molecular weight of RefChem:1078312 is 405.21 g/mol.
Where can I buy RefChem:1078312?
You can request a quote for RefChem:1078312 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078312?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078312 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.