TL;DR: (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile (CAS 1164461-64-6) is a chemical compound with molecular formula C18H18N2O2 and molecular weight 294.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-(4-methylphenyl)-3-(5-morpholin-4-ylfuran-2-yl)prop-2-enenitrile
Also Known As: BAS 08198899, (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile, (2E)-2-(4-methylphenyl)-3-[5-(morpholin-4-yl)furan-2-yl]prop-2-enenitrile, (E)-2-(4-methylphenyl)-3-(5-morpholin-4-ylfuran-2-yl)prop-2-enenitrile
| Molecular Formula | C18H18N2O2 |
| Molecular Weight | 294.13684 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.13684 Da |
| Heavy Atoms | 22 |
| Complexity | 439.0 |
| SMILES | CC1=CC=C(C=C1)/C(=C\C2=CC=C(O2)N3CCOCC3)/C#N |
| InChIKey | MNGQDDDZOQOAOL-VBKFSLOCSA-N |
The XLogP value of 3.2 indicates that (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile has 0 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 (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile is 1164461-64-6.
The molecular formula of (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile is C18H18N2O2.
The molecular weight of (E)-3-(5-Morpholin-4-yl-furan-2-yl)-2-p-tolyl-acrylonitrile is 294.13684 g/mol.
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