TL;DR: (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one (CAS 1057113-82-2) is a chemical compound with molecular formula C12H13ClN2O and molecular weight 236.07164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one
Also Known As: (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one, 3-[2-(4-chlorophenyl)hydrazin-1-ylidene]cyclohexan-1-one, cyclohexane-1,3-dione-mono-(4-chlorophenyl)hydrazone, G23406
| Molecular Formula | C12H13ClN2O |
| Molecular Weight | 236.07164 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.07164 Da |
| Heavy Atoms | 16 |
| Complexity | 283.0 |
| SMILES | C1C/C(=N/NC2=CC=C(C=C2)Cl)/CC(=O)C1 |
| InChIKey | JXNOLRGMLTVKMK-PTNGSMBKSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one. With a topological polar surface area (TPSA) of 41.5 Ų, (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one has 1 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 (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one is 1057113-82-2.
The molecular formula of (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one is C12H13ClN2O.
The molecular weight of (3Z)-3-[(4-chlorophenyl)hydrazinylidene]cyclohexan-1-one is 236.07164 g/mol.
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