TL;DR: (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane (CAS 156517-64-5) is a chemical compound with molecular formula C35H33NP2 and molecular weight 529.2088 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-benzyl-4-diphenylphosphanylpyrrolidin-3-yl)-diphenylphosphane
Also Known As: (3R,4R)-3,4-Bis(diphenylphosphino)-1-benzylpyrrolidine, (+)-(3R,4R)-Bis(diphenylphosphino)-1-benzylpyrrolidine, (3S,4S)-3,4-Bis(diphenylphosphino)-1-benzylpyrrolidine, (1-benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane, (3S,4S)-(-)-1-Benzyl-3,4-bis(diphenylphosphino)pyrrolidine
| Molecular Formula | C35H33NP2 |
| Molecular Weight | 529.2088 g/mol |
| XLogP | 7.3 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 529.2088 Da |
| Heavy Atoms | 38 |
| Complexity | 583.0 |
| SMILES | C1C(C(CN1CC2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)P(C5=CC=CC=C5)C6=CC=CC=C6 |
| InChIKey | GYKMEKRMASHMIH-UHFFFAOYSA-N |
The XLogP value of 7.3 indicates that (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane is 156517-64-5.
The molecular formula of (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane is C35H33NP2.
The molecular weight of (1-Benzyl-4-diphenylphosphanyl-pyrrolidin-3-yl)-diphenyl-phosphane is 529.2088 g/mol.
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