N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
TL;DR: N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide (CAS 1010863-27-0) is a chemical compound with molecular formula C20H28N8O2S and molecular weight 444.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(tert-butylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
Also Known As: N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide, N-[4-(tert-butylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
| Molecular Formula | C20H28N8O2S |
|---|---|
| Molecular Weight | 444.21 g/mol |
| LogP | 3.46082 |
| Topological Polar Surface Area | 128.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.2056 |
| Heavy Atoms | 31 |
| Complexity | 1120.9866 |
Chemical Identifiers
| CAS Number | 1010863-27-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C2=CNN=C2)C3=NC(=NC(=N3)NC(C)(C)C)NC(C)C |
Product Overview
N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide (CAS 1010863-27-0), with molecular formula C20H28N8O2S and molecular weight 444.21 g/mol. IUPAC: N-[4-(tert-butylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide.
Chemical Property Profile of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
Property Insights of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
The XLogP value of 3.46082 indicates that N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.79 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide. Following Lipinski's Rule of Five, N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide has 3 hydrogen bond donor(s) and 8 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-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide?
The CAS number of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide is 1010863-27-0.
What is the molecular formula of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide?
The molecular formula of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide is C20H28N8O2S.
What is the molecular weight of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide?
The molecular weight of N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide is 444.21 g/mol.
Where can I buy N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide?
You can request a quote for N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)-4-methyl-N-(1H-pyrazol-4-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.