(E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide
TL;DR: (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide (CAS 1010868-49-1) is a chemical compound with molecular formula C30H28N6O2S and molecular weight 536.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)ethenyl]-1-phenylpyrazol-3-yl]-N,N-diethylbenzenesulfonamide
Also Known As: (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide, 3-[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)ethenyl]-1-phenylpyrazol-3-yl]-N,N-diethylbenzenesulfonamide, 3-{4-[(E)-2-cyano-2-(1-methyl-1H-benzimidazol-2-yl)ethenyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-diethylbenzenesulfonamide
| Molecular Formula | C30H28N6O2S |
|---|---|
| Molecular Weight | 536.20 g/mol |
| LogP | 5.52068 |
| Topological Polar Surface Area | 96.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 536.19946 |
| Heavy Atoms | 39 |
| Complexity | 1824.3665 |
Chemical Identifiers
| CAS Number | 1010868-49-1 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C3=NC4=CC=CC=C4N3C)C5=CC=CC=C5 |
Product Overview
(E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide (CAS 1010868-49-1), with molecular formula C30H28N6O2S and molecular weight 536.20 g/mol. IUPAC: 3-[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)ethenyl]-1-phenylpyrazol-3-yl]-N,N-diethylbenzenesulfonamide.
Chemical Property Profile of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide
Property Insights of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide
The XLogP value of 5.52068 indicates that (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.81 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide. Following Lipinski's Rule of Five, (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide has 0 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 (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide?
The CAS number of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide is 1010868-49-1.
What is the molecular formula of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide?
The molecular formula of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide is C30H28N6O2S.
What is the molecular weight of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide?
The molecular weight of (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide is 536.20 g/mol.
Where can I buy (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide?
You can request a quote for (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(4-(2-cyano-2-(1-methyl-1H-benzo[d]imidazol-2-yl)vinyl)-1-phenyl-1H-pyrazol-3-yl)-N,N-diethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.