6049-0983 Screening compound: 2,2,3,3-tetrafluoro-N-[2-(1H-indol-3-yl)ethyl]propanamide
Chemical Structure Depiction of ChemDiv screening compound 6049-0983
2,2,3,3-tetrafluoro-N-[2-(1H-indol-3-yl)ethyl]propanamide
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
6049-0983
Molecular Formula
C13H12F4N2O (C13 H12 F4 N2 O)
Compound Name
2,2,3,3-tetrafluoro-N-[2-(1H-indol-3-yl)ethyl]propanamide
IUPAC name
2233-tetrafluoro-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILES
O=C(C(C(F)F)(F)F)NCCc1c[nH]c2c1cccc2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
288.24
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
2.412
Distribution Coefficient, logD
2.412
Water Solubility, LogSw
-2.78
Polar Surface Area
34.636
Acid Dissociation Constant (pKa)
11.70
Base Dissociation Constant (pKb)
-3.08
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
30.77
6049-0983 in Drug Discovery
Included in Screening Libraries
Antiviral Annotated Library (21441 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Agro
References: we are preparing a list of scientific research reports with 6049-0983 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)