F424-0175 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of ChemDiv screening compound F424-0175
N-(3-chloro-2-methylphenyl)-2-{[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}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
F424-0175
Molecular Formula
C20H15ClFN5O2S (C20 H15 ClFN5 O2 S)
Compound Name
N-(3-chloro-2-methylphenyl)-2-{[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
IUPAC name
N-(3-chloro-2-methylphenyl)-2-{[2-(4-fluorophenyl)-4-oxo-4H5H-pyrazolo[15-d][124]triazin-7-yl]sulfanyl}acetamide
SMILES
Cc(c(NC(CSC(n(c1c2)nc2-c(cc2)ccc2F)=NNC1=O)=O)ccc1)c1Cl
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
443.89
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.323
Distribution Coefficient, logD
4.322
Water Solubility, LogSw
-4.47
Polar Surface Area
73.766
Acid Dissociation Constant (pKa)
9.85
Base Dissociation Constant (pKb)
2.02
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
10.00
F424-0175 in Drug Discovery
Included in Screening Libraries
Chelators targeting matrix metalloproteinases library (8930 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Proteases
References: we are preparing a list of scientific research reports with F424-0175 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)