TL;DR: (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene (CAS 140447-78-5) is a chemical compound with molecular formula C18H18O2 and molecular weight 266.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-4-[4-(4-methoxyphenyl)buta-1,3-dienyl]benzene
Also Known As: NCIOpen2_002662, 1,4-Di-p-methoxyphenyl-butadien, 1-(2-N-Boc-aminoethyl)piperazine, 1,4-Bis(4-methoxyphenyl)buta-1,3-diene, (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H18O2 |
| Molecular Weight | 266.13068 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.13068 Da |
| Heavy Atoms | 20 |
| Complexity | 273.0 |
| SMILES | COC1=CC=C(C=C1)C=CC=CC2=CC=C(C=C2)OC |
| InChIKey | OTJAKIZOANJRSA-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene is 140447-78-5.
The molecular formula of (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene is C18H18O2.
The molecular weight of (1E,3E)-1,4-bis(4-methoxyphenyl)buta-1,3-diene is 266.13068 g/mol.
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