1-(dimethylamino)-4-phenoxypent-1-en-3-one
TL;DR: 1-(dimethylamino)-4-phenoxypent-1-en-3-one (CAS 338976-01-5) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)-4-phenoxypent-1-en-3-one
Also Known As: 1-(dimethylamino)-4-phenoxypent-1-en-3-one, dimethylaminophenoxypentenone, 1-dimethylamino-4-phenoxy-pent-1-en-3-one, 1-(dimethylamino)-4-phenoxy-pent-1-en-3-one, 9C-064
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 2.0983 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 357.45517 |
Chemical Identifiers
| CAS Number | 338976-01-5 |
|---|---|
| SMILES | CC(C(=O)C=CN(C)C)OC1=CC=CC=C1 |
Product Overview
1-(dimethylamino)-4-phenoxypent-1-en-3-one (CAS 338976-01-5), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 1-(dimethylamino)-4-phenoxypent-1-en-3-one.
Chemical Property Profile of 1-(dimethylamino)-4-phenoxypent-1-en-3-one
Property Insights of 1-(dimethylamino)-4-phenoxypent-1-en-3-one
The XLogP value of 2.0983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(dimethylamino)-4-phenoxypent-1-en-3-one. With a topological polar surface area (TPSA) of 29.54 Ų, 1-(dimethylamino)-4-phenoxypent-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(dimethylamino)-4-phenoxypent-1-en-3-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 1-(dimethylamino)-4-phenoxypent-1-en-3-one?
The CAS number of 1-(dimethylamino)-4-phenoxypent-1-en-3-one is 338976-01-5.
What is the molecular formula of 1-(dimethylamino)-4-phenoxypent-1-en-3-one?
The molecular formula of 1-(dimethylamino)-4-phenoxypent-1-en-3-one is C13H17NO2.
What is the molecular weight of 1-(dimethylamino)-4-phenoxypent-1-en-3-one?
The molecular weight of 1-(dimethylamino)-4-phenoxypent-1-en-3-one is 219.13 g/mol.
Where can I buy 1-(dimethylamino)-4-phenoxypent-1-en-3-one?
You can request a quote for 1-(dimethylamino)-4-phenoxypent-1-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(dimethylamino)-4-phenoxypent-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(dimethylamino)-4-phenoxypent-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.