TL;DR: 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- (CAS 109757-87-1) is a chemical compound with molecular formula C30H35N3O and molecular weight 453.278 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-5-phenylpyrrolidin-2-one
Also Known As: 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl-, 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-5-phenylpyrrolidin-2-one, 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-5-phenyl-pyrrolidin-2-one, 1-{3-[4-(Diphenylmethyl)piperazin-1-yl]propyl}-5-phenylpyrrolidin-2-one, 2-Pyrrolidinone,1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl
| Molecular Formula | C30H35N3O |
| Molecular Weight | 453.278 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.278 Da |
| Heavy Atoms | 34 |
| Complexity | 595.0 |
| SMILES | C1CC(=O)N(C1C2=CC=CC=C2)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | OLWARBWXQAYMOI-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.8 Ų, 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- has 0 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-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- is 109757-87-1.
The molecular formula of 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- is C30H35N3O.
The molecular weight of 2-Pyrrolidinone, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl- is 453.278 g/mol.
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