TL;DR: Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- (CAS 133661-86-6) is a chemical compound with molecular formula C13H17ClN2O and molecular weight 252.10294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-1-(2-chlorophenyl)ethylideneamino]-2,2-dimethylpropanamide
Also Known As: Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)-, (E)-2,2-Dimethylpropanoic acid (1-(2-chlorophenyl)ethylidene)hydrazide, N'-[1-(2-chlorophenyl)ethylidene]-2,2-dimethylpropanehydrazide, N -(2-Chloro-alpha-methylbenzylidene)-2,2-dimethylpropanoic acid hydrazide, BRN 4252849
| Molecular Formula | C13H17ClN2O |
| Molecular Weight | 252.10294 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.10294 Da |
| Heavy Atoms | 17 |
| Complexity | 307.0 |
| SMILES | C/C(=N\NC(=O)C(C)(C)C)/C1=CC=CC=C1Cl |
| InChIKey | KNRPPCUHKNZUID-OQLLNIDSSA-N |
The XLogP value of 3.4 indicates that Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.5 Ų, Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- is 133661-86-6.
The molecular formula of Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- is C13H17ClN2O.
The molecular weight of Propanoic acid, 2,2-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)- is 252.10294 g/mol.
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