C434-0153 Screening compound: N-ethyl-N-(4-fluorophenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}acetamide
Chemical Structure Depiction of ChemDiv screening compound C434-0153
N-ethyl-N-(4-fluorophenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-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
C434-0153
Molecular Formula
C20H16FN3O3 (C20 H16 FN3 O3)
Compound Name
N-ethyl-N-(4-fluorophenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}acetamide
IUPAC name
N-ethyl-N-(4-fluorophenyl)-2-{4-oxo-1H4H-chromeno[43-c]pyrazol-1-yl}acetamide
SMILES
CCN(C(Cn1ncc2c1-c(cccc1)c1OC2=O)=O)c(cc1)ccc1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
365.36
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.932
Distribution Coefficient, logD
2.932
Water Solubility, LogSw
-3.39
Polar Surface Area
49.550
Acid Dissociation Constant (pKa)
22.65
Base Dissociation Constant (pKb)
-0.79
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.00
C434-0153 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Receptor's ligands
- Immune system
References: we are preparing a list of scientific research reports with C434-0153 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)