5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one
TL;DR: 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one (CAS 84175-54-2) is a chemical compound with molecular formula C15H21NO and molecular weight 231.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)-4,4-dimethyl-1-phenylpent-1-en-3-one
Also Known As: 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one, NCI60_003568, 5-(dimethylamino)-4,4-dimethyl-1-phenylpent-1-en-3-one, 5-(dimethylamino)-4,4-dimethyl-1-phenyl-pent-1-en-3-one
| Molecular Formula | C15H21NO |
|---|---|
| Molecular Weight | 231.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 231.16231 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 84175-54-2 |
|---|---|
| SMILES | CC(C)(CN(C)C)C(=O)C=CC1=CC=CC=C1 |
| InChIKey | OFYZAIZRLXHEOE-UHFFFAOYSA-N |
Product Overview
5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one (CAS 84175-54-2), with molecular formula C15H21NO and molecular weight 231.16 g/mol. IUPAC: 5-(dimethylamino)-4,4-dimethyl-1-phenylpent-1-en-3-one.
Chemical Property Profile of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one
Property Insights of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one. With a topological polar surface area (TPSA) of 20.3 Ų, 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-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 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one?
The CAS number of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one is 84175-54-2.
What is the molecular formula of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one?
The molecular formula of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one is C15H21NO.
What is the molecular weight of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one?
The molecular weight of 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one is 231.16 g/mol.
Where can I buy 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one?
You can request a quote for 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-4,4-dimethyl-1-phenyl-1-penten-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.