![N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide structure](/static/products/6814/681459-13-2.webp)
N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide
TL;DR: N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide (CAS 681459-13-2) is a chemical compound with molecular formula C22H28N6O2 and molecular weight 408.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide
Also Known As: N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide, Butanamide, N,N'-[6-(3-cyanophenyl)-1,3,5-triazine-2,4-diyl], N,N'-(6-(3-Cyanophenyl)-1,3,5-triazine-2,4-diyl)bis(3,3-dimethylbutanamide)
| Molecular Formula | C22H28N6O2 |
|---|---|
| Molecular Weight | 408.23 g/mol |
| LogP | 4.15968 |
| Topological Polar Surface Area | 120.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.2274 |
| Heavy Atoms | 30 |
| Complexity | 932.093 |
Chemical Identifiers
| CAS Number | 681459-13-2 |
|---|---|
| SMILES | CC(C)(C)CC(=O)NC1=NC(=NC(=N1)C2=CC=CC(=C2)C#N)NC(=O)CC(C)(C)C |
Product Overview
N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide (CAS 681459-13-2), with molecular formula C22H28N6O2 and molecular weight 408.23 g/mol. IUPAC: N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide.
Chemical Property Profile of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide
Property Insights of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide
The XLogP value of 4.15968 indicates that N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide. Following Lipinski's Rule of Five, N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide has 2 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 N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide?
The CAS number of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide is 681459-13-2.
What is the molecular formula of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide?
The molecular formula of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide is C22H28N6O2.
What is the molecular weight of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide?
The molecular weight of N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide is 408.23 g/mol.
Where can I buy N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide?
You can request a quote for N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(3-cyanophenyl)-6-(3,3-dimethylbutanoylamino)-1,3,5-triazin-2-yl]-3,3-dimethylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.