5-22-13-00145 (Beilstein Handbook Reference)
TL;DR: 5-22-13-00145 (Beilstein Handbook Reference) (CAS 54087-49-9) is a chemical compound with molecular formula C24H29N3O2 and molecular weight 391.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]-2-piperidin-1-ylacetamide
Also Known As: 5-22-13-00145 (Beilstein Handbook Reference), N-(4-(1,2,3,4-Tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-1-piperidineacetamide, 1-Piperidineacetamide, N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-, N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]-2-piperidin-1-ylacetamide, N-[4-(3-Hydroxy-4,4-dimethyl-1,4-dihydroisoquinolin-1-yl)phenyl]-2-(piperidin-1-yl)acetamide
| Molecular Formula | C24H29N3O2 |
|---|---|
| Molecular Weight | 391.23 g/mol |
| LogP | 3.6078 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.22598 |
| Heavy Atoms | 29 |
| Complexity | 898.59674 |
Chemical Identifiers
| CAS Number | 54087-49-9 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)NC(=O)CN4CCCCC4)C |
Product Overview
5-22-13-00145 (Beilstein Handbook Reference) (CAS 54087-49-9), with molecular formula C24H29N3O2 and molecular weight 391.23 g/mol. IUPAC: N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]-2-piperidin-1-ylacetamide.
Chemical Property Profile of 5-22-13-00145 (Beilstein Handbook Reference)
Property Insights of 5-22-13-00145 (Beilstein Handbook Reference)
The XLogP value of 3.6078 indicates that 5-22-13-00145 (Beilstein Handbook Reference) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-22-13-00145 (Beilstein Handbook Reference). Following Lipinski's Rule of Five, 5-22-13-00145 (Beilstein Handbook Reference) has 2 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 5-22-13-00145 (Beilstein Handbook Reference)?
The CAS number of 5-22-13-00145 (Beilstein Handbook Reference) is 54087-49-9.
What is the molecular formula of 5-22-13-00145 (Beilstein Handbook Reference)?
The molecular formula of 5-22-13-00145 (Beilstein Handbook Reference) is C24H29N3O2.
What is the molecular weight of 5-22-13-00145 (Beilstein Handbook Reference)?
The molecular weight of 5-22-13-00145 (Beilstein Handbook Reference) is 391.23 g/mol.
Where can I buy 5-22-13-00145 (Beilstein Handbook Reference)?
You can request a quote for 5-22-13-00145 (Beilstein Handbook Reference) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-22-13-00145 (Beilstein Handbook Reference)?
Yes, KEHONG BIO provides custom synthesis services for 5-22-13-00145 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.