P573-6696 Screening compound: 2-{7-[(4-fluorophenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrimidin-2-yl}-N-phenylacetamide
Chemical Structure Depiction of ChemDiv screening compound P573-6696
2-{7-[(4-fluorophenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrimidin-2-yl}-N-phenylacetamide
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
P573-6696
Molecular Formula
C19H15FN6O2 (C19 H15 FN6 O2)
Compound Name
2-{7-[(4-fluorophenyl)amino]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrimidin-2-yl}-N-phenylacetamide
IUPAC name
2-{7-[(4-fluorophenyl)amino]-3-oxo-2H3H-[124]triazolo[43-a]pyrimidin-2-yl}-N-phenylacetamide
SMILES
O=C(CN(C(N1C=C2)=O)N=C1N=C2Nc(cc1)ccc1F)Nc1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
378.37
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.633
Distribution Coefficient, logD
2.631
Water Solubility, LogSw
-3.05
Polar Surface Area
74.995
Acid Dissociation Constant (pKa)
9.64
Base Dissociation Constant (pKb)
2.92
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.30
P573-6696 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Proteases
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with P573-6696 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)