RefChem:83907
TL;DR: RefChem:83907 (CAS 65749-35-1) is a chemical compound with molecular formula C36H46N4O4 and molecular weight 598.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-butyl-N-[4-[(4-cyanophenyl)carbamoylamino]-3-hydroxyphenyl]acetamide
Also Known As: 2-(2,4-Bis(1,1-dimethylpropyl)phenoxy)-N-(4-((((4-cyanophenyl)amino)carbonyl)amino)-3-hydroxyphenyl)hexanamide, 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-n-butyl-n-(4-{[(4-cyanophenyl)carbamoyl]amino}-3-hydroxyphenyl)acetamide, Hexanamide, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-N-(4-((((4-cyanophenyl)amino)carbonyl)amino)-3-hydroxyphenyl)-, 2-[2,4-BIS(1,1-DIMETHYLPROPYL)PHENOXY]-N-[4-[[[(4-CYANOPHENYL)AMINO]CARBONYL]AMINO]-3-HYDROXYPHENYL]HEXANAMIDE, 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-{[(4-cyanophenyl)carbamoyl]amino}-3-hydroxyphenyl)hexanamide
| Molecular Formula | C36H46N4O4 |
|---|---|
| Molecular Weight | 598.35 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 598.3519 |
| Heavy Atoms | 44 |
| Complexity | 966.0 |
Chemical Identifiers
| CAS Number | 65749-35-1 |
|---|---|
| SMILES | CCCCN(C1=CC(=C(C=C1)NC(=O)NC2=CC=C(C=C2)C#N)O)C(=O)COC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC |
| InChIKey | CBIYEZHFUKPMGW-UHFFFAOYSA-N |
Product Overview
RefChem:83907 (CAS 65749-35-1), with molecular formula C36H46N4O4 and molecular weight 598.35 g/mol. IUPAC: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-butyl-N-[4-[(4-cyanophenyl)carbamoylamino]-3-hydroxyphenyl]acetamide.
Chemical Property Profile of RefChem:83907
Property Insights of RefChem:83907
The XLogP value of 8.6 indicates that RefChem:83907 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:83907. Following Lipinski's Rule of Five, RefChem:83907 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:83907?
The CAS number of RefChem:83907 is 65749-35-1.
What is the molecular formula of RefChem:83907?
The molecular formula of RefChem:83907 is C36H46N4O4.
What is the molecular weight of RefChem:83907?
The molecular weight of RefChem:83907 is 598.35 g/mol.
Where can I buy RefChem:83907?
You can request a quote for RefChem:83907 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:83907?
Yes, KEHONG BIO provides custom synthesis services for RefChem:83907 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.