A3996/0170300
TL;DR: A3996/0170300 (CAS 899368-50-4) is a chemical compound with molecular formula C33H34N2O3 and molecular weight 506.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-N-[2-(2-phenylethylcarbamoyl)phenyl]benzamide
Also Known As: A3996/0170300, 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-N-[2-(2-phenylethylcarbamoyl)phenyl]benzamide, 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-N-[2-(phenethylcarbamoyl)phenyl]benzamide, 2-(2-{[5-METHYL-2-(PROPAN-2-YL)PHENOXY]METHYL}BENZAMIDO)-N-(2-PHENYLETHYL)BENZAMIDE, 2-[(2-isopropyl-5-methylphenoxy)methyl]-N-(2-{[(2-phenylethyl)amino]carbonyl}phenyl)benzamide
| Molecular Formula | C33H34N2O3 |
|---|---|
| Molecular Weight | 506.26 g/mol |
| LogP | 6.92222 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 506.25696 |
| Heavy Atoms | 38 |
| Complexity | 1396.5273 |
Chemical Identifiers
| CAS Number | 899368-50-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC2=CC=CC=C2C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4 |
Product Overview
A3996/0170300 (CAS 899368-50-4), with molecular formula C33H34N2O3 and molecular weight 506.26 g/mol. IUPAC: 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-N-[2-(2-phenylethylcarbamoyl)phenyl]benzamide.
Chemical Property Profile of A3996/0170300
Property Insights of A3996/0170300
The XLogP value of 6.92222 indicates that A3996/0170300 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for A3996/0170300. Following Lipinski's Rule of Five, A3996/0170300 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3996/0170300?
The CAS number of A3996/0170300 is 899368-50-4.
What is the molecular formula of A3996/0170300?
The molecular formula of A3996/0170300 is C33H34N2O3.
What is the molecular weight of A3996/0170300?
The molecular weight of A3996/0170300 is 506.26 g/mol.
Where can I buy A3996/0170300?
You can request a quote for A3996/0170300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3996/0170300?
Yes, KEHONG BIO provides custom synthesis services for A3996/0170300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.