TL;DR: 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)- (CAS 106392-48-7) is a chemical compound with molecular formula C16H20N2O2 and molecular weight 272.15247 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyano-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]prop-2-enamide
Also Known As: ST 271, 2-cyano-3-(4-hydroxy-3,5-diisopropylphenyl)acrylamide, 2-cyano-3-(4-hydroxy-3,5-diisopropylphenyl)prop-2-enamide, 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)-, 2-cyano-3-(4-hydroxy-3,5-diisopropyl-phenyl)prop-2-enamide
| Molecular Formula | C16H20N2O2 |
| Molecular Weight | 272.15247 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 87.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.15247 Da |
| Heavy Atoms | 20 |
| Complexity | 413.0 |
| SMILES | CC(C)C1=CC(=CC(=C1O)C(C)C)C=C(C#N)C(=O)N |
| InChIKey | HMLQHJRJKQDTKW-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)-. Following Lipinski's Rule of Five, 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)- is 106392-48-7.
The molecular formula of 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)- is C16H20N2O2.
The molecular weight of 2-Propenamide, 2-cyano-3-(4-hydroxy-3,5-bis(1-methylethyl)phenyl)- is 272.15247 g/mol.
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