TL;DR: 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) (CAS 1520-44-1) is a chemical compound with molecular formula C16H18 and molecular weight 210.14085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-phenylbutan-2-ylbenzene
Also Known As: butane-1,3-diyldibenzene, 1,3-DIPHENYLBUTANE, Ethanesulfonamide, 4-phenylbutan-2-ylbenzene, (3-Phenylbutyl)benzene
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H18 |
| Molecular Weight | 210.14085 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.14085 Da |
| Heavy Atoms | 16 |
| Complexity | 172.0 |
| SMILES | CC(CCC1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | PDINXYLAVFUHSA-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) is 1520-44-1.
The molecular formula of 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) is C16H18.
The molecular weight of 1,1'-(1-Methyl-1,3-propanediyl)bis(benzene) is 210.14085 g/mol.
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