TL;DR: (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II) (CAS 132773-08-1) is a chemical compound with molecular formula C14H13N3NiOS and molecular weight 329.01328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azane;nickel(2+);(NE,Z)-N-[(2-oxidophenyl)methylidene]benzenecarbohydrazonothioate
Also Known As: (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II), Nickel, ammine(benzenecarbothioic acid ((2-hydroxyphenyl)methylene)hydrazidato(2-))-
| Molecular Formula | C14H13N3NiOS |
| Molecular Weight | 329.01328 g/mol |
| XLogP | 2.2473 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.01328 Da |
| Heavy Atoms | 20 |
| Complexity | 311.0 |
| SMILES | C1=CC=C(C=C1)/C(=N/N=C/C2=CC=CC=C2[O-])/[S-].N.[Ni+2] |
| InChIKey | ZGMJUORGSIRREJ-OVWKBUNZSA-L |
The XLogP value of 2.2473 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II). With a topological polar surface area (TPSA) of 49.8 Ų, (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II) has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II) is 132773-08-1.
The molecular formula of (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II) is C14H13N3NiOS.
The molecular weight of (2-Hydroxybenzaldehyde thiobenzoylhydrazonato)ammino-nickel(II) is 329.01328 g/mol.
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