GL104-1
TL;DR: GL104-1 (CAS 117665-37-9) is a chemical compound with molecular formula C21H16N4O6 and molecular weight 420.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-nitro-2-oxochromene-3-carboxamide
Also Known As: GL104-1, BIM-0035228.P001, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-6-nitro-2-oxo-2H-chromene-3-carboxamide, F0283-0039, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-nitro-2-oxochromene-3-carboxamide
| Molecular Formula | C21H16N4O6 |
|---|---|
| Molecular Weight | 420.11 g/mol |
| LogP | 2.75132 |
| Topological Polar Surface Area | 129.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.107 |
| Heavy Atoms | 31 |
| Complexity | 1463.2444 |
Chemical Identifiers
| CAS Number | 117665-37-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O |
Product Overview
GL104-1 (CAS 117665-37-9), with molecular formula C21H16N4O6 and molecular weight 420.11 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-nitro-2-oxochromene-3-carboxamide.
Chemical Property Profile of GL104-1
Property Insights of GL104-1
The XLogP value of 2.75132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for GL104-1. The TPSA of 129.38 Ų falls within the moderate polarity range, balancing permeability and solubility for GL104-1. Following Lipinski's Rule of Five, GL104-1 has 1 hydrogen bond donor(s) and 6 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 GL104-1?
The CAS number of GL104-1 is 117665-37-9.
What is the molecular formula of GL104-1?
The molecular formula of GL104-1 is C21H16N4O6.
What is the molecular weight of GL104-1?
The molecular weight of GL104-1 is 420.11 g/mol.
Where can I buy GL104-1?
You can request a quote for GL104-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GL104-1?
Yes, KEHONG BIO provides custom synthesis services for GL104-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.