3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one
TL;DR: 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one (CAS 4636-87-7) is a chemical compound with molecular formula C16H15NO and molecular weight 237.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one
Also Known As: 3,4,5-trimethoxy-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]
| Molecular Formula | C16H15NO |
|---|---|
| Molecular Weight | 237.12 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.11537 |
| Heavy Atoms | 18 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 4636-87-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C=CC(=O)C2=CN=C(C=C2)C |
| InChIKey | LTJPWCBPPMHVKO-UHFFFAOYSA-N |
Product Overview
3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one (CAS 4636-87-7), with molecular formula C16H15NO and molecular weight 237.12 g/mol. IUPAC: 3-(4-methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one.
Chemical Property Profile of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one
Property Insights of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one
The XLogP value of 3.4 indicates that 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)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, 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)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.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one?
The CAS number of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one is 4636-87-7.
What is the molecular formula of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one?
The molecular formula of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one is C16H15NO.
What is the molecular weight of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one?
The molecular weight of 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one is 237.12 g/mol.
Where can I buy 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one?
You can request a quote for 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylphenyl)-1-(6-methyl-3-pyridinyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.