DE(2-chloro)-4-chloro-icerguastat
TL;DR: DE(2-chloro)-4-chloro-icerguastat (CAS 132685-68-8) is a chemical compound with molecular formula C8H9ClN4 and molecular weight 196.05157 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-(4-chlorophenyl)methylideneamino]guanidine
Also Known As: p-chlorobenzylideneaminoguanidine, DE(2-chloro)-4-chloro-icerguastat, (E)-2-(4-chlorobenzylidene)hydrazine-1-carboximidamide, N-Amidino-p-chlorbenzaldehydhydrazon, 3793AD
Technical Specifications
| Molecular Formula | C8H9ClN4 |
| Molecular Weight | 196.05157 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 76.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.05157 Da |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
| SMILES | C1=CC(=CC=C1/C=N/N=C(N)N)Cl |
| InChIKey | UYZKWRHTYCCDMP-LFYBBSHMSA-N |
Chemical Property Profile of DE(2-chloro)-4-chloro-icerguastat
Property Insights of DE(2-chloro)-4-chloro-icerguastat
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DE(2-chloro)-4-chloro-icerguastat. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for DE(2-chloro)-4-chloro-icerguastat. Following Lipinski's Rule of Five, DE(2-chloro)-4-chloro-icerguastat has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of DE(2-chloro)-4-chloro-icerguastat?
The CAS number of DE(2-chloro)-4-chloro-icerguastat is 132685-68-8.
What is the molecular formula of DE(2-chloro)-4-chloro-icerguastat?
The molecular formula of DE(2-chloro)-4-chloro-icerguastat is C8H9ClN4.
What is the molecular weight of DE(2-chloro)-4-chloro-icerguastat?
The molecular weight of DE(2-chloro)-4-chloro-icerguastat is 196.05157 g/mol.
Where can I buy DE(2-chloro)-4-chloro-icerguastat?
You can request a quote for DE(2-chloro)-4-chloro-icerguastat directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for DE(2-chloro)-4-chloro-icerguastat?
Yes, CoreyChem provides custom synthesis services for DE(2-chloro)-4-chloro-icerguastat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.