TL;DR: 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone (CAS 15272-67-0) is a chemical compound with molecular formula C27H25Cl2NO2 and molecular weight 465.12622 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(3,4-dichlorophenyl)-2-phenyl-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one
Also Known As: 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone, (E)-1-(3,4-dichlorophenyl)-2-phenyl-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one, 3,4-Dichloro-alpha-phenyl-4/'-[2-(1-pyrrolidinyl)ethoxy]chalcone, 3-(3,4-Dichlorophenyl)-2-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)acrylophenone, 3-(3,4-Dichlorophenyl)-2-phenyl-4'-beta-pyrrolidinoethoxyacrylophenone
| Molecular Formula | C27H25Cl2NO2 |
| Molecular Weight | 465.12622 g/mol |
| XLogP | 7.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.12622 Da |
| Heavy Atoms | 32 |
| Complexity | 619.0 |
| SMILES | C1CCN(C1)CCOC2=CC=C(C=C2)/C=C(\C3=CC=CC=C3)/C(=O)C4=CC(=C(C=C4)Cl)Cl |
| InChIKey | KBMDSZPBXQAJPY-HKOYGPOVSA-N |
The XLogP value of 7.1 indicates that 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone is 15272-67-0.
The molecular formula of 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone is C27H25Cl2NO2.
The molecular weight of 3,4-Dichloro-alpha-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)chalcone is 465.12622 g/mol.
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