TL;DR: 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide (CAS 154295-08-6) is a chemical compound with molecular formula C13H11Cl2N3O2 and molecular weight 311.02283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dichlorophenoxy)-N-(1H-pyrrol-2-ylmethylideneamino)acetamide
Also Known As: ML239 Analog, 2-(2,4-dichlorophenoxy)-N'-(1H-pyrrol-2-ylmethylene)acetohydrazide, 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide
| Molecular Formula | C13H11Cl2N3O2 |
| Molecular Weight | 311.02283 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.02283 Da |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
| SMILES | C1=CNC(=C1)C=NNC(=O)COC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | ZMIAMADGCOUQBT-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide. Following Lipinski's Rule of Five, 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide is 154295-08-6.
The molecular formula of 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide is C13H11Cl2N3O2.
The molecular weight of 2-(2,4-dichlorophenoxy)-N'-(2-pyrrolylidenemethyl)acetohydrazide is 311.02283 g/mol.
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