F810-0064 Screening compound: N-benzyl-2-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-yl}acetamide
Chemical Structure Depiction of ChemDiv screening compound F810-0064
N-benzyl-2-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-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
F810-0064
Molecular Formula
C18H15N5O2 (C18 H15 N5 O2)
Compound Name
N-benzyl-2-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-yl}acetamide
IUPAC name
N-benzyl-2-{3-oxo-2H3H-[124]triazolo[43-c]quinazolin-2-yl}acetamide
SMILES
O=C(CN1N=C(c(cccc2)c2N=C2)N2C1=O)NCc1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
333.35
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.592
Distribution Coefficient, logD
1.592
Water Solubility, LogSw
-2.48
Polar Surface Area
66.159
Acid Dissociation Constant (pKa)
13.82
Base Dissociation Constant (pKb)
3.74
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.10
F810-0064 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Kinases
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with F810-0064 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)