F417-0316 Screening compound: N-(butan-2-yl)-2-{1-ethyl-4-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinoxalin-5-yl}acetamide
Chemical Structure Depiction of ChemDiv screening compound F417-0316
N-(butan-2-yl)-2-{1-ethyl-4-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinoxalin-5-yl}acetamide
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
F417-0316
Molecular Formula
C17H21N5O2 (C17 H21 N5 O2)
Compound Name
N-(butan-2-yl)-2-{1-ethyl-4-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinoxalin-5-yl}acetamide
IUPAC name
N-(butan-2-yl)-2-{1-ethyl-4-oxo-4H5H-[124]triazolo[43-a]quinoxalin-5-yl}acetamide
SMILES
CCC(C)NC(CN(c(cccc1)c1-n1c2nnc1CC)C2=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
327.39
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.148
Distribution Coefficient, logD
1.148
Water Solubility, LogSw
-2.14
Polar Surface Area
64.532
Acid Dissociation Constant (pKa)
15.91
Base Dissociation Constant (pKb)
1.51
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
41.20
F417-0316 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
Antiviral Library (67538 compounds)
Soluble Diversity Library (15920 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Agro
- Others
References: we are preparing a list of scientific research reports with F417-0316 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)