AB00680816-01
TL;DR: AB00680816-01 (CAS 898412-06-1) is a chemical compound with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)furan-2-carboxamide
Also Known As: AB00680816-01, F2668-0070, N-{2-oxo-1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-trien-7-yl}furan-2-carboxamide, N-(3-oxo-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinolin-9-yl)furan-2-carboxamide, N-(2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)furan-2-carboxamide
| Molecular Formula | C17H16N2O3 |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 2.7573 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.1161 |
| Heavy Atoms | 22 |
| Complexity | 732.2646 |
Chemical Identifiers
| CAS Number | 898412-06-1 |
|---|---|
| SMILES | C1CC2=C3C(=CC(=C2)NC(=O)C4=CC=CO4)CCC(=O)N3C1 |
Product Overview
AB00680816-01 (CAS 898412-06-1), with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol. IUPAC: N-(2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)furan-2-carboxamide.
Chemical Property Profile of AB00680816-01
Property Insights of AB00680816-01
The XLogP value of 2.7573 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00680816-01. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00680816-01. Following Lipinski's Rule of Five, AB00680816-01 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 AB00680816-01?
The CAS number of AB00680816-01 is 898412-06-1.
What is the molecular formula of AB00680816-01?
The molecular formula of AB00680816-01 is C17H16N2O3.
What is the molecular weight of AB00680816-01?
The molecular weight of AB00680816-01 is 296.12 g/mol.
Where can I buy AB00680816-01?
You can request a quote for AB00680816-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00680816-01?
Yes, KEHONG BIO provides custom synthesis services for AB00680816-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.