RefChem:1075751
TL;DR: RefChem:1075751 (CAS 3043-06-9) is a chemical compound with molecular formula C24H32ClNO3 and molecular weight 417.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpyrrolidin-1-ium-2-yl)methyl 2-butoxy-2,2-diphenylacetate chloride
Also Known As: Acetic acid, 2-butoxy-2,2-diphenyl-, (1-methyl-2-pyrrolidinyl)methyl ester, hydrochloride, 2-Butoxy-2,2-diphenylacetic acid (1-methyl-2-pyrrolidinyl)methyl ester hydrochloride, (1-methylpyrrolidin-1-ium-2-yl)methyl 2-butoxy-2,2-diphenylacetate chloride, RefChem:1075751
| Molecular Formula | C24H32ClNO3 |
|---|---|
| Molecular Weight | 417.21 g/mol |
| LogP | -0.03 |
| Topological Polar Surface Area | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 417.20706 |
| Heavy Atoms | 29 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 3043-06-9 |
|---|---|
| SMILES | CCCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC3CCC[NH+]3C.[Cl-] |
| InChIKey | LMZAZNPGRNNGHF-UHFFFAOYSA-N |
Product Overview
RefChem:1075751 (CAS 3043-06-9), with molecular formula C24H32ClNO3 and molecular weight 417.21 g/mol. IUPAC: (1-methylpyrrolidin-1-ium-2-yl)methyl 2-butoxy-2,2-diphenylacetate chloride.
Chemical Property Profile of RefChem:1075751
Property Insights of RefChem:1075751
The XLogP value of -0.03 indicates that RefChem:1075751 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:1075751 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1075751 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:1075751?
The CAS number of RefChem:1075751 is 3043-06-9.
What is the molecular formula of RefChem:1075751?
The molecular formula of RefChem:1075751 is C24H32ClNO3.
What is the molecular weight of RefChem:1075751?
The molecular weight of RefChem:1075751 is 417.21 g/mol.
Where can I buy RefChem:1075751?
You can request a quote for RefChem:1075751 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075751?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075751 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.