(E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide
TL;DR: (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide (CAS 885886-82-8) is a chemical compound with molecular formula C19H21ClN6O and molecular weight 384.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[N'-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]acetamide
Also Known As: (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide, N-[(E)-{[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]AMINO}[(4,6-DIMETHYLPYRIMIDIN-2-YL)AMINO]METHYLIDENE]ACETAMIDE, N-[N'-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]acetamide, N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}acetamide
| Molecular Formula | C19H21ClN6O |
|---|---|
| Molecular Weight | 384.15 g/mol |
| LogP | 3.37484 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.14655 |
| Heavy Atoms | 27 |
| Complexity | 990.35254 |
Chemical Identifiers
| CAS Number | 885886-82-8 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C)C |
Product Overview
(E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide (CAS 885886-82-8), with molecular formula C19H21ClN6O and molecular weight 384.15 g/mol. IUPAC: N-[N'-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]acetamide.
Chemical Property Profile of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide
Property Insights of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide
The XLogP value of 3.37484 indicates that (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.06 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide. Following Lipinski's Rule of Five, (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide has 3 hydrogen bond donor(s) and 4 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 (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide?
The CAS number of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide is 885886-82-8.
What is the molecular formula of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide?
The molecular formula of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide is C19H21ClN6O.
What is the molecular weight of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide?
The molecular weight of (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide is 384.15 g/mol.
Where can I buy (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide?
You can request a quote for (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(((2-(5-chloro-1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.