TimTec1_002712
TL;DR: TimTec1_002712 (CAS 17656-58-5) is a chemical compound with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]hydroxylamine
Also Known As: TimTec1_002712, (1Z)-1-[(3,4-dimethoxyphenyl)-nitrosomethylidene]-6,7-dimeth
| Molecular Formula | C20H20N2O5 |
|---|---|
| Molecular Weight | 368.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 82.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 368.1372 |
| Heavy Atoms | 27 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 17656-58-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=NO)C2=NC=CC3=CC(=C(C=C32)OC)OC)OC |
| InChIKey | MWEXIACDYMVJBD-UHFFFAOYSA-N |
Product Overview
TimTec1_002712 (CAS 17656-58-5), with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol. IUPAC: N-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]hydroxylamine.
Chemical Property Profile of TimTec1_002712
Property Insights of TimTec1_002712
The XLogP value of 3.9 indicates that TimTec1_002712 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.4 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_002712. Following Lipinski's Rule of Five, TimTec1_002712 has 1 hydrogen bond donor(s) and 7 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 TimTec1_002712?
The CAS number of TimTec1_002712 is 17656-58-5.
What is the molecular formula of TimTec1_002712?
The molecular formula of TimTec1_002712 is C20H20N2O5.
What is the molecular weight of TimTec1_002712?
The molecular weight of TimTec1_002712 is 368.14 g/mol.
Where can I buy TimTec1_002712?
You can request a quote for TimTec1_002712 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_002712?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_002712 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.