RefChem:316390
TL;DR: RefChem:316390 (CAS 3043-09-2) is a chemical compound with molecular formula C23H30ClNO3 and molecular weight 403.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-propan-2-ylpyrrolidin-1-ium-2-yl)methyl 2-methoxy-2,2-diphenylacetate chloride
Also Known As: Acetic acid, 2,2-diphenyl-2-methoxy-, (1-isopropyl-2-pyrrolidinyl)methyl ester, hydrochloride, 2,2-Diphenyl-2-methoxyacetic acid (1-isopropyl-2-pyrrolidinyl)methyl ester hydrochloride, (1-propan-2-ylpyrrolidin-1-ium-2-yl)methyl 2-methoxy-2,2-diphenylacetate chloride, RefChem:316390
| Molecular Formula | C23H30ClNO3 |
|---|---|
| Molecular Weight | 403.19 g/mol |
| LogP | -0.42 |
| Topological Polar Surface Area | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.1914 |
| Heavy Atoms | 28 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 3043-09-2 |
|---|---|
| SMILES | CC(C)[NH+]1CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC.[Cl-] |
| InChIKey | GCAVAEWHCWUFEL-UHFFFAOYSA-N |
Product Overview
RefChem:316390 (CAS 3043-09-2), with molecular formula C23H30ClNO3 and molecular weight 403.19 g/mol. IUPAC: (1-propan-2-ylpyrrolidin-1-ium-2-yl)methyl 2-methoxy-2,2-diphenylacetate chloride.
Chemical Property Profile of RefChem:316390
Property Insights of RefChem:316390
The XLogP value of -0.42 indicates that RefChem:316390 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:316390 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:316390 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:316390?
The CAS number of RefChem:316390 is 3043-09-2.
What is the molecular formula of RefChem:316390?
The molecular formula of RefChem:316390 is C23H30ClNO3.
What is the molecular weight of RefChem:316390?
The molecular weight of RefChem:316390 is 403.19 g/mol.
Where can I buy RefChem:316390?
You can request a quote for RefChem:316390 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316390?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316390 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.