TL;DR: (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one (CAS 16212-56-9) is a chemical compound with molecular formula C14H10ClNO and molecular weight 243.04509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(3-chlorophenyl)-1-pyridin-2-ylprop-2-en-1-one
Also Known As: (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one, (E)-3-(3-chlorophenyl)-1-pyridin-2-ylprop-2-en-1-one, AB00082493-01
| Molecular Formula | C14H10ClNO |
| Molecular Weight | 243.04509 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.04509 Da |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
| SMILES | C1=CC=NC(=C1)C(=O)/C=C/C2=CC(=CC=C2)Cl |
| InChIKey | HYYAYBSDFNHBDZ-BQYQJAHWSA-N |
The XLogP value of 3.6 indicates that (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.0 Ų, (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one 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 (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one is 16212-56-9.
The molecular formula of (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one is C14H10ClNO.
The molecular weight of (E)-3-(3-Chlorophenyl)-1-(pyridin-2-yl)prop-2-en-1-one is 243.04509 g/mol.
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