Y508-3569 Screening compound: 2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-morpholino-1-propanone
Chemical Structure Depiction of ChemDiv screening compound Y508-3569
2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-morpholino-1-propanone
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
Y508-3569
Molecular Formula
C12H16F3N3O2 (C12 H16 F3 N3 O2)
Compound Name
2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-morpholino-1-propanone
IUPAC name
n/a
SMILES
CC(C(N1CCOCC1)=O)n1nc(C(F)(F)F)cc1C
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
291.27
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
0.853
Distribution Coefficient, logD
0.853
Water Solubility, LogSw
-0.85
Polar Surface Area
39.084
Acid Dissociation Constant (pKa)
22.86
Base Dissociation Constant (pKb)
-1.28
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
66.70
References: we are preparing a list of scientific research reports with Y508-3569 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)