(2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one
TL;DR: (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one (CAS 1185239-44-4) is a chemical compound with molecular formula C13H10N2O and molecular weight 210.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-pyridin-3-yl-1-pyridin-4-ylprop-2-en-1-one
Also Known As: 3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-one, (E)-3PO;3PO, (E)-3-pyridin-3-yl-1-pyridin-4-ylprop-2-en-1-one, s7639, 3PO, >=98% (HPLC)
| Molecular Formula | C13H10N2O |
|---|---|
| Molecular Weight | 210.08 g/mol |
| LogP | 2.3727 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.07932 |
| Heavy Atoms | 16 |
| Complexity | 491.85574 |
Chemical Identifiers
| CAS Number | 1185239-44-4 |
|---|---|
| SMILES | C1=CC(=CN=C1)/C=C/C(=O)C2=CC=NC=C2 |
Product Overview
(2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one (CAS 1185239-44-4), with molecular formula C13H10N2O and molecular weight 210.08 g/mol. IUPAC: (E)-3-pyridin-3-yl-1-pyridin-4-ylprop-2-en-1-one.
Chemical Property Profile of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one
Property Insights of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one
The XLogP value of 2.3727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one. With a topological polar surface area (TPSA) of 42.85 Ų, (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one?
The CAS number of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one is 1185239-44-4.
What is the molecular formula of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one?
The molecular formula of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one is C13H10N2O.
What is the molecular weight of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one?
The molecular weight of (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one is 210.08 g/mol.
Where can I buy (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one?
You can request a quote for (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(3-Pyridinyl)-1-(4-pyridinyl)-2-propen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.