TL;DR: BAS 01966290 (CAS 1321786-19-9) is a chemical compound with molecular formula C18H19N5O4 and molecular weight 369.1437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-3-[(Z)-1-cyano-2-(3,4,5-trimethoxyphenyl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile
Also Known As: BAS 01966290, 5-amino-3-[(Z)-1-cyano-2-(3,4,5-trimethoxyphenyl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile, 3-[(1Z)-1-cyano-2-(3,4,5-trimethoxyphenyl)vinyl]-5-amino-1-(2-hydroxyethyl)pyr azole-4-carbonitrile, 5-AMINO-3-[(1Z)-1-CYANO-2-(3,4,5-TRIMETHOXYPHENYL)ETH-1-EN-1-YL]-1-(2-HYDROXYETHYL)-1H-PYRAZOLE-4-CARBONITRILE, 5-amino-3-[(Z)-1-cyano-2-(3,4,5-trimethoxyphenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
| Molecular Formula | C18H19N5O4 |
| Molecular Weight | 369.1437 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 369.1437 Da |
| Heavy Atoms | 27 |
| Complexity | 610.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C(\C#N)/C2=NN(C(=C2C#N)N)CCO |
| InChIKey | IDYIGKMKNGTANZ-WUXMJOGZSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01966290. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01966290. Following Lipinski's Rule of Five, BAS 01966290 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 01966290 is 1321786-19-9.
The molecular formula of BAS 01966290 is C18H19N5O4.
The molecular weight of BAS 01966290 is 369.1437 g/mol.
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