TL;DR: Tyrphostin AG 974 (CAS 148741-31-5) is a chemical compound with molecular formula C10H5IN2O2 and molecular weight 311.93958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3,4-dihydroxy-5-iodophenyl)methylidene]propanedinitrile
Also Known As: Tyrphostin AG 974, 2-(3,4-dihydroxy-5-iodobenzylidene)malononitrile, [(3,4-Dihydroxy-5-iodophenyl)methylidene]propanedinitrile, 2-[(3,4-Dihydroxy-5-iodophenyl)methylene]propanedinitrile, 2-[(3,4-dihydroxy-5-iodo-phenyl)methylidene]propanedinitrile
| Molecular Formula | C10H5IN2O2 |
| Molecular Weight | 311.93958 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.93958 Da |
| Heavy Atoms | 15 |
| Complexity | 344.0 |
| SMILES | C1=C(C=C(C(=C1O)O)I)C=C(C#N)C#N |
| InChIKey | WPXSPHPYZHPIPO-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tyrphostin AG 974. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tyrphostin AG 974. Following Lipinski's Rule of Five, Tyrphostin AG 974 has 2 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 AG 974 is 148741-31-5.
The molecular formula of Tyrphostin AG 974 is C10H5IN2O2.
The molecular weight of Tyrphostin AG 974 is 311.93958 g/mol.
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