3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone
TL;DR: 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone (CAS 198488-67-4) is a chemical compound with molecular formula C19H24N2O and molecular weight 296.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1,7-dipyridin-2-ylheptan-4-one
Also Known As: 3,3-dimethyl-1,7-di-2-pyridyl-4-heptanone, 3,3-dimethyl-1,7-dipyridin-2-ylheptan-4-one, 3,3-dimethyl-1,7-di(2-pyridinyl)-4-heptanone, 3,3-dimethyl-1,7-di(pyridin-2-yl)heptan-4-one
| Molecular Formula | C19H24N2O |
|---|---|
| Molecular Weight | 296.19 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 42.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.18887 |
| Heavy Atoms | 22 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 198488-67-4 |
|---|---|
| SMILES | CC(C)(CCC1=CC=CC=N1)C(=O)CCCC2=CC=CC=N2 |
| InChIKey | WGEXTDHFGARDBI-UHFFFAOYSA-N |
Product Overview
3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone (CAS 198488-67-4), with molecular formula C19H24N2O and molecular weight 296.19 g/mol. IUPAC: 3,3-dimethyl-1,7-dipyridin-2-ylheptan-4-one.
Chemical Property Profile of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone
Property Insights of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone
The XLogP value of 3.3 indicates that 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.9 Ų, 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone 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 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone?
The CAS number of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone is 198488-67-4.
What is the molecular formula of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone?
The molecular formula of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone is C19H24N2O.
What is the molecular weight of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone?
The molecular weight of 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone is 296.19 g/mol.
Where can I buy 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone?
You can request a quote for 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-1,7-di(2-pyridinyl)-4-heptanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.