1-Butanone, 1-phenyl-4-(4-pyridinyl)-
TL;DR: 1-Butanone, 1-phenyl-4-(4-pyridinyl)- (CAS 101089-46-7) is a chemical compound with molecular formula C15H15NO and molecular weight 225.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-4-pyridin-4-ylbutan-1-one
Also Known As: NCIOpen2_006899, 1-Butanone, 1-phenyl-4-(4-pyridinyl)-, 1-phenyl-4-pyridin-4-ylbutan-1-one, 1-phenyl-4-(pyridin-4-yl)butan-1-one, 1-Phenyl-4-[4]pyridyl-butan-1-on
| Molecular Formula | C15H15NO |
|---|---|
| Molecular Weight | 225.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 225.11537 |
| Heavy Atoms | 17 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 101089-46-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CCCC2=CC=NC=C2 |
| InChIKey | KKTFGAZNZKVDJT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanone, 1-phenyl-4-(4-pyridinyl)- (CAS 101089-46-7), with molecular formula C15H15NO and molecular weight 225.12 g/mol. IUPAC: 1-phenyl-4-pyridin-4-ylbutan-1-one.
Chemical Property Profile of 1-Butanone, 1-phenyl-4-(4-pyridinyl)-
Property Insights of 1-Butanone, 1-phenyl-4-(4-pyridinyl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanone, 1-phenyl-4-(4-pyridinyl)-. With a topological polar surface area (TPSA) of 30.0 Ų, 1-Butanone, 1-phenyl-4-(4-pyridinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanone, 1-phenyl-4-(4-pyridinyl)- 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 1-Butanone, 1-phenyl-4-(4-pyridinyl)-?
The CAS number of 1-Butanone, 1-phenyl-4-(4-pyridinyl)- is 101089-46-7.
What is the molecular formula of 1-Butanone, 1-phenyl-4-(4-pyridinyl)-?
The molecular formula of 1-Butanone, 1-phenyl-4-(4-pyridinyl)- is C15H15NO.
What is the molecular weight of 1-Butanone, 1-phenyl-4-(4-pyridinyl)-?
The molecular weight of 1-Butanone, 1-phenyl-4-(4-pyridinyl)- is 225.12 g/mol.
Where can I buy 1-Butanone, 1-phenyl-4-(4-pyridinyl)-?
You can request a quote for 1-Butanone, 1-phenyl-4-(4-pyridinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 1-phenyl-4-(4-pyridinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 1-phenyl-4-(4-pyridinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.