IFLab1_005558
TL;DR: IFLab1_005558 (CAS 1005162-23-1) is a chemical compound with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-16-oxo-2-oxa-15-azatetracyclo[7.5.3.01,10.03,8]heptadeca-3,5,7-triene-17-carboxamide
Also Known As: IFLab1_005558, IDI1_010961, F1321-0011, N,N-diethyl-12-oxo-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide, N,N-diethyl-16-oxo-2-oxa-15-azatetracyclo[7.5.3.01,10.03,8]heptadeca-3,5,7-triene-17-carboxamide
| Molecular Formula | C20H26N2O3 |
|---|---|
| Molecular Weight | 342.19 g/mol |
| LogP | 2.6635 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.19434 |
| Heavy Atoms | 25 |
| Complexity | 699.9366 |
Chemical Identifiers
| CAS Number | 1005162-23-1 |
|---|---|
| SMILES | CCN(CC)C(=O)C1C2C3CCCCC3(NC1=O)OC4=CC=CC=C24 |
Product Overview
IFLab1_005558 (CAS 1005162-23-1), with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol. IUPAC: N,N-diethyl-16-oxo-2-oxa-15-azatetracyclo[7.5.3.01,10.03,8]heptadeca-3,5,7-triene-17-carboxamide.
Chemical Property Profile of IFLab1_005558
Property Insights of IFLab1_005558
The XLogP value of 2.6635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IFLab1_005558. With a topological polar surface area (TPSA) of 58.64 Ų, IFLab1_005558 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_005558 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 IFLab1_005558?
The CAS number of IFLab1_005558 is 1005162-23-1.
What is the molecular formula of IFLab1_005558?
The molecular formula of IFLab1_005558 is C20H26N2O3.
What is the molecular weight of IFLab1_005558?
The molecular weight of IFLab1_005558 is 342.19 g/mol.
Where can I buy IFLab1_005558?
You can request a quote for IFLab1_005558 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_005558?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_005558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.