ASN 13828216
TL;DR: ASN 13828216 (CAS 879626-00-3) is a chemical compound with molecular formula C19H20ClN7O and molecular weight 397.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-imidazol-5-yl)ethyl]carbamimidoyl]benzamide
Also Known As: ASN 13828216, 2-chloro-N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(1H-imidazol-4-yl)ethyl]amino}methylidene]benzamide, (2E)-3-[(4,6-dimethylpyrimidin-2-yl)amino]-1-(2-chlorophenyl)-3-[(2-imidazol-4 -ylethyl)amino]-2-azaprop-2-en-1-one, (E)-N-(((2-(1H-imidazol-4-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)-2-chlorobenzamide, 2-chloro-N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-imidazol-5-yl)ethyl]carbamimidoyl]benzamide
| Molecular Formula | C19H20ClN7O |
|---|---|
| Molecular Weight | 397.14 g/mol |
| LogP | 2.91054 |
| Topological Polar Surface Area | 107.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.14178 |
| Heavy Atoms | 28 |
| Complexity | 965.45703 |
Chemical Identifiers
| CAS Number | 879626-00-3 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=NCCC2=CN=CN2)NC(=O)C3=CC=CC=C3Cl)C |
Product Overview
ASN 13828216 (CAS 879626-00-3), with molecular formula C19H20ClN7O and molecular weight 397.14 g/mol. IUPAC: 2-chloro-N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-imidazol-5-yl)ethyl]carbamimidoyl]benzamide.
Chemical Property Profile of ASN 13828216
Property Insights of ASN 13828216
The XLogP value of 2.91054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13828216. The TPSA of 107.95 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13828216. Following Lipinski's Rule of Five, ASN 13828216 has 3 hydrogen bond donor(s) and 5 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 ASN 13828216?
The CAS number of ASN 13828216 is 879626-00-3.
What is the molecular formula of ASN 13828216?
The molecular formula of ASN 13828216 is C19H20ClN7O.
What is the molecular weight of ASN 13828216?
The molecular weight of ASN 13828216 is 397.14 g/mol.
Where can I buy ASN 13828216?
You can request a quote for ASN 13828216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13828216?
Yes, KEHONG BIO provides custom synthesis services for ASN 13828216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.