8010-2569 Screening compound: 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
Chemical Structure Depiction of ChemDiv screening compound 8010-2569
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-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
8010-2569
Molecular Formula
C7H7BrF3N3O (C7 H7 BrF3 N3 O)
Compound Name
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
IUPAC name
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
SMILES
Cc(n(CC(N)=O)nc1C(F)(F)F)c1Br
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
286.05
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
0.684
Distribution Coefficient, logD
0.684
Water Solubility, LogSw
-0.24
Polar Surface Area
48.373
Acid Dissociation Constant (pKa)
15.34
Base Dissociation Constant (pKb)
-0.06
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.90
8010-2569 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
Fragments Library (11262 compounds)
Crystallographic and 19F NMR fragment-libraries (624 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Agro
- Agro
- Fragments
References: we are preparing a list of scientific research reports with 8010-2569 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)