Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride
TL;DR: Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride (CAS 73758-14-2) is a chemical compound with molecular formula C19H30ClNO2 and molecular weight 339.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(piperidin-1-ium-1-ylmethyl)-1-(4-propoxyphenyl)butan-1-one chloride
Also Known As: 2-(Piperinomethyl)-4'-propoxybutyrophenone hydrochloride, BUTYROPHENONE, 2-(PIPERIDINOMETHYL)-4'-PROPOXY-, HYDROCHLORIDE, 1-Butanone, 2-(1-piperidinylmethyl)-1-(4-propoxyphenyl)-, hydrochloride, 2-(piperidin-1-ium-1-ylmethyl)-1-(4-propoxyphenyl)butan-1-one chloride, RefChem:331375
| Molecular Formula | C19H30ClNO2 |
|---|---|
| Molecular Weight | 339.20 g/mol |
| LogP | -0.24 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 339.1965 |
| Heavy Atoms | 23 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 73758-14-2 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)C(=O)C(CC)C[NH+]2CCCCC2.[Cl-] |
| InChIKey | ABYFZNVWPHYYHB-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride (CAS 73758-14-2), with molecular formula C19H30ClNO2 and molecular weight 339.20 g/mol. IUPAC: 2-(piperidin-1-ium-1-ylmethyl)-1-(4-propoxyphenyl)butan-1-one chloride.
Chemical Property Profile of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride
Property Insights of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride
The XLogP value of -0.24 indicates that Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride has 1 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 Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride?
The CAS number of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride is 73758-14-2.
What is the molecular formula of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride?
The molecular formula of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride is C19H30ClNO2.
What is the molecular weight of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride?
The molecular weight of Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride is 339.20 g/mol.
Where can I buy Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride?
You can request a quote for Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 2-(piperidinomethyl)-4'-propoxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.