1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate
TL;DR: 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate (CAS 78467-47-7) is a chemical compound with molecular formula C29H36N2O7 and molecular weight 524.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(4-benzylpiperidin-1-yl)-2-hydroxypropoxy]-1-prop-2-enyl-3,4-dihydroquinolin-2-one;oxalic acid
Also Known As: 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate, 2(1H)-Quinolinone, 3,4-dihydro-5-(2-hydroxy-3-(4-(phenylmethyl)-1-piperidinyl)propoxy)-1-(2-propenyl)-, ethanedioate (1:1) (salt), 1-allyl-5-[2-hydroxy-(4-benzyl-1-piperidyl)propoxy]-3,4-dihydrocarbostyril monooxalate, 5-[3-(4-benzylpiperidin-1-yl)-2-hydroxypropoxy]-1-prop-2-enyl-3,4-dihydroquinolin-2-one; oxalic acid, Oxalic acid--5-[3-(4-benzylpiperidin-1-yl)-2-hydroxypropoxy]-1-(prop-2-en-1-yl)-3,4-dihydroquinolin-2(1H)-one (1/1)
| Molecular Formula | C29H36N2O7 |
|---|---|
| Molecular Weight | 524.25 g/mol |
| LogP | 3.0018 |
| Topological Polar Surface Area | 127.61 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 524.25226 |
| Heavy Atoms | 38 |
| Complexity | 1085.3604 |
Chemical Identifiers
| CAS Number | 78467-47-7 |
|---|---|
| SMILES | C=CCN1C(=O)CCC2=C1C=CC=C2OCC(CN3CCC(CC3)CC4=CC=CC=C4)O.C(=O)(C(=O)O)O |
Product Overview
1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate (CAS 78467-47-7), with molecular formula C29H36N2O7 and molecular weight 524.25 g/mol. IUPAC: 5-[3-(4-benzylpiperidin-1-yl)-2-hydroxypropoxy]-1-prop-2-enyl-3,4-dihydroquinolin-2-one;oxalic acid.
Chemical Property Profile of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate
Property Insights of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate
The XLogP value of 3.0018 indicates that 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate. Following Lipinski's Rule of Five, 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate?
The CAS number of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate is 78467-47-7.
What is the molecular formula of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate?
The molecular formula of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate is C29H36N2O7.
What is the molecular weight of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate?
The molecular weight of 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate is 524.25 g/mol.
Where can I buy 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate?
You can request a quote for 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate?
Yes, KEHONG BIO provides custom synthesis services for 1-Allyl-5-(2-hydroxy-(4-benzyl-1-piperidyl)propoxy)-3,4-dihydrocarbostyril monooxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.