AB00680710-01
TL;DR: AB00680710-01 (CAS 898411-18-2) is a chemical compound with molecular formula C17H22N4O3 and molecular weight 330.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(dimethylamino)ethyl]-N'-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)oxamide
Also Known As: AB00680710-01, F2666-0191, N-[2-(dimethylamino)ethyl]-N'-{2-oxo-1-azatricyclo[6.3.1.0^{4,12}]dodeca-4,6,8(12)-trien-6-yl}ethanediamide, N1-(2-(dimethylamino)ethyl)-N2-(2-oxo-2,4,5,6-tetrahydro-1H-pyrrolo[3,2,1-ij]quinolin-8-yl)oxalamide, N-[2-(dimethylamino)ethyl]-N'-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)oxamide
| Molecular Formula | C17H22N4O3 |
|---|---|
| Molecular Weight | 330.17 g/mol |
| LogP | 0.1382 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.1692 |
| Heavy Atoms | 24 |
| Complexity | 699.3212 |
Chemical Identifiers
| CAS Number | 898411-18-2 |
|---|---|
| SMILES | CN(C)CCNC(=O)C(=O)NC1=CC2=C3C(=C1)CC(=O)N3CCC2 |
Product Overview
AB00680710-01 (CAS 898411-18-2), with molecular formula C17H22N4O3 and molecular weight 330.17 g/mol. IUPAC: N-[2-(dimethylamino)ethyl]-N'-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)oxamide.
Chemical Property Profile of AB00680710-01
Property Insights of AB00680710-01
The XLogP value of 0.1382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00680710-01. The TPSA of 81.75 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00680710-01. Following Lipinski's Rule of Five, AB00680710-01 has 2 hydrogen bond donor(s) and 4 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 AB00680710-01?
The CAS number of AB00680710-01 is 898411-18-2.
What is the molecular formula of AB00680710-01?
The molecular formula of AB00680710-01 is C17H22N4O3.
What is the molecular weight of AB00680710-01?
The molecular weight of AB00680710-01 is 330.17 g/mol.
Where can I buy AB00680710-01?
You can request a quote for AB00680710-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00680710-01?
Yes, KEHONG BIO provides custom synthesis services for AB00680710-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.