![1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one structure](/static/products/4870/487007-77-2.webp)
1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one
TL;DR: 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one (CAS 487007-77-2) is a chemical compound with molecular formula C18H24N2O and molecular weight 284.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one
Also Known As: BAS 03774958, 1-[4-(diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one, AP-518/40848419, 1-[4-(diethylamino)-2-butynyl]-4-phenyl-2-pyrrolidinone, 1-(4-Diethylamino-but-2-ynyl)-4-phenyl-pyrrolidin-2-one
| Molecular Formula | C18H24N2O |
|---|---|
| Molecular Weight | 284.19 g/mol |
| LogP | 2.3477 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 284.18887 |
| Heavy Atoms | 21 |
| Complexity | 511.015 |
Chemical Identifiers
| CAS Number | 487007-77-2 |
|---|---|
| SMILES | CCN(CC)CC#CCN1CC(CC1=O)C2=CC=CC=C2 |
Product Overview
1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one (CAS 487007-77-2), with molecular formula C18H24N2O and molecular weight 284.19 g/mol. IUPAC: 1-[4-(diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one.
Chemical Property Profile of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one
Property Insights of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one
The XLogP value of 2.3477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one. With a topological polar surface area (TPSA) of 23.55 Ų, 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-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 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one?
The CAS number of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one is 487007-77-2.
What is the molecular formula of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one?
The molecular formula of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one is C18H24N2O.
What is the molecular weight of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one?
The molecular weight of 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one is 284.19 g/mol.
Where can I buy 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one?
You can request a quote for 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Diethylamino)but-2-ynyl]-4-phenylpyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.