TL;DR: Tyrphostin 11 (CAS 122520-73-4) is a chemical compound with molecular formula C13H8N2O2 and molecular weight 224.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-[4-(2,2-dicyanoethenyl)phenyl]prop-2-enoic acid
Also Known As: Cinnbzmeprcn2, Tyrphostin 11, (4-(1-Carboxyethen-2-yl)benzylidene)malononitrile, benzylidenemalononitrile (BMN) deriv. 11, ((4-(1-Carboxyethen-2-yl)phenyl)methylene)propanedinitrile
| Molecular Formula | C13H8N2O2 |
| Molecular Weight | 224.05858 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.05858 Da |
| Heavy Atoms | 17 |
| Complexity | 419.0 |
| SMILES | C1=CC(=CC=C1/C=C/C(=O)O)C=C(C#N)C#N |
| InChIKey | FYUKHNUSVGJQFX-AATRIKPKSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tyrphostin 11. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Tyrphostin 11. Following Lipinski's Rule of Five, Tyrphostin 11 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Tyrphostin 11 is 122520-73-4.
The molecular formula of Tyrphostin 11 is C13H8N2O2.
The molecular weight of Tyrphostin 11 is 224.05858 g/mol.
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