RefChem:368641
TL;DR: RefChem:368641 (CAS 4119-02-2) is a chemical compound with molecular formula C29H35NO5 and molecular weight 477.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-3-methyl-4-[methyl(2-phenylethyl)amino]-1-phenylbutan-2-ol;oxalic acid
Also Known As: alpha-Benzyl-alpha-(1-methyl-2-(methylphenethylamino)ethyl)phenethyl alcohol oxalate, Phenethyl alcohol, alpha-benzyl-alpha-(1-methyl-2-(methylphenethylamino)ethyl)-, oxalate, 2-benzyl-3-methyl-4-[methyl(phenethyl)amino]-1-phenylbutan-2-ol; oxalic acid, Oxalic acid--2-benzyl-3-methyl-4-[methyl(2-phenylethyl)amino]-1-phenylbutan-2-ol (1/1), RefChem:368641
| Molecular Formula | C29H35NO5 |
|---|---|
| Molecular Weight | 477.25 g/mol |
| LogP | 4.1691 |
| Topological Polar Surface Area | 98.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 477.25153 |
| Heavy Atoms | 35 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 4119-02-2 |
|---|---|
| SMILES | CC(CN(C)CCC1=CC=CC=C1)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O.C(=O)(C(=O)O)O |
| InChIKey | RGIXIHSELFDBBY-UHFFFAOYSA-N |
Product Overview
RefChem:368641 (CAS 4119-02-2), with molecular formula C29H35NO5 and molecular weight 477.25 g/mol. IUPAC: 2-benzyl-3-methyl-4-[methyl(2-phenylethyl)amino]-1-phenylbutan-2-ol;oxalic acid.
Chemical Property Profile of RefChem:368641
Property Insights of RefChem:368641
The XLogP value of 4.1691 indicates that RefChem:368641 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:368641. Following Lipinski's Rule of Five, RefChem:368641 has 3 hydrogen bond donor(s) and 6 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:368641?
The CAS number of RefChem:368641 is 4119-02-2.
What is the molecular formula of RefChem:368641?
The molecular formula of RefChem:368641 is C29H35NO5.
What is the molecular weight of RefChem:368641?
The molecular weight of RefChem:368641 is 477.25 g/mol.
Where can I buy RefChem:368641?
You can request a quote for RefChem:368641 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:368641?
Yes, KEHONG BIO provides custom synthesis services for RefChem:368641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.