RefChem:348283
TL;DR: RefChem:348283 (CAS 57227-55-1) is a chemical compound with molecular formula C28H37N3O7 and molecular weight 527.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(butylamino)-1-oxo-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-2-yl]benzamide;oxalic acid
Also Known As: CR 648, O-(2-Pyrrolidyl-N'-ethyl)-benzoyl-DL-tyrosyl-n-butylamide oxalate, (+-)-alpha-(Benzoylamino)-N-butyl-4-(2-(1-pyrrolidinyl)ethoxy)hydrocinnamamide oxalate, Hydrocinnamamide, alpha-(benzoylamino)-N-butyl-4-(2-(1-pyrrolidinyl)ethoxy)-, oxalate, (+-)-, N-[1-(butylamino)-1-oxo-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-2-yl]benzamide; oxalic acid
| Molecular Formula | C28H37N3O7 |
|---|---|
| Molecular Weight | 527.26 g/mol |
| LogP | 2.57 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 527.2631 |
| Heavy Atoms | 38 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 57227-55-1 |
|---|---|
| SMILES | CCCCNC(=O)C(CC1=CC=C(C=C1)OCCN2CCCC2)NC(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O |
| InChIKey | MJRYBAFYCOORDJ-UHFFFAOYSA-N |
Product Overview
RefChem:348283 (CAS 57227-55-1), with molecular formula C28H37N3O7 and molecular weight 527.26 g/mol. IUPAC: N-[1-(butylamino)-1-oxo-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-2-yl]benzamide;oxalic acid.
Chemical Property Profile of RefChem:348283
Property Insights of RefChem:348283
The XLogP value of 2.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:348283. The TPSA of 145.0 Ų indicates high polarity, suggesting RefChem:348283 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:348283 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:348283?
The CAS number of RefChem:348283 is 57227-55-1.
What is the molecular formula of RefChem:348283?
The molecular formula of RefChem:348283 is C28H37N3O7.
What is the molecular weight of RefChem:348283?
The molecular weight of RefChem:348283 is 527.26 g/mol.
Where can I buy RefChem:348283?
You can request a quote for RefChem:348283 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:348283?
Yes, KEHONG BIO provides custom synthesis services for RefChem:348283 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.