4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate
TL;DR: 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate (CAS 42576-07-8) is a chemical compound with molecular formula C20H25NO2 and molecular weight 311.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-3-methyl-1,2-diphenylbutan-2-yl) propanoate
Also Known As: DINORPROPOXYPHENE, 4-AMINO-3-METHYL-1,2-DIPHENYLBUTAN-2-YL PROPANOATE, (4-amino-3-methyl-1,2-diphenylbutan-2-yl) propanoate
| Molecular Formula | C20H25NO2 |
|---|---|
| Molecular Weight | 311.19 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 311.18854 |
| Heavy Atoms | 23 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 42576-07-8 |
|---|---|
| SMILES | CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN |
| InChIKey | LYBJBWHVNPHBMH-UHFFFAOYSA-N |
Product Overview
4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate (CAS 42576-07-8), with molecular formula C20H25NO2 and molecular weight 311.19 g/mol. IUPAC: (4-amino-3-methyl-1,2-diphenylbutan-2-yl) propanoate.
Chemical Property Profile of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate
Property Insights of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate
The XLogP value of 3.2 indicates that 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate has 1 hydrogen bond donor(s) and 3 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 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate?
The CAS number of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate is 42576-07-8.
What is the molecular formula of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate?
The molecular formula of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate is C20H25NO2.
What is the molecular weight of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate?
The molecular weight of 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate is 311.19 g/mol.
Where can I buy 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate?
You can request a quote for 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-3-methyl-1,2-diphenylbutan-2-YL propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.