TL;DR: SKI 178 (CAS 1359880-51-5) is a chemical compound with molecular formula C21H22N4O4 and molecular weight 394.1641 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
Also Known As: SKI 178, EX-A8537, N'-(1-(3,4-Dimethoxyphenyl)ethylidene)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide, SKI-178; SKI 178; SKI178, EC-000.2507
| Molecular Formula | C21H22N4O4 |
| Molecular Weight | 394.1641 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 97.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1641 Da |
| Heavy Atoms | 29 |
| Complexity | 565.0 |
| SMILES | C/C(=N\NC(=O)C1=CC(=NN1)C2=CC=C(C=C2)OC)/C3=CC(=C(C=C3)OC)OC |
| InChIKey | GMFUWEBOUKIKRP-LPYMAVHISA-N |
The XLogP value of 3.3 indicates that SKI 178 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.8 Ų falls within the moderate polarity range, balancing permeability and solubility for SKI 178. Following Lipinski's Rule of Five, SKI 178 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of SKI 178 is 1359880-51-5.
The molecular formula of SKI 178 is C21H22N4O4.
The molecular weight of SKI 178 is 394.1641 g/mol.
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