Y500-6515 Screening compound: (4-bromo-1H-pyrazol-1-yl)(3-fluorophenyl)methanone
Chemical Structure Depiction of ChemDiv screening compound Y500-6515
(4-bromo-1H-pyrazol-1-yl)(3-fluorophenyl)methanone
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
Y500-6515
Molecular Formula
C10H6BrFN2O (C10 H6 BrFN2 O)
Compound Name
(4-bromo-1H-pyrazol-1-yl)(3-fluorophenyl)methanone
IUPAC name
4-bromo-1-(3-fluorobenzoyl)-1H-pyrazole
SMILES
O=C(c1cc(F)ccc1)n1ncc(Br)c1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
269.07
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
2.210
Distribution Coefficient, logD
2.210
Water Solubility, LogSw
-2.41
Polar Surface Area
27.792
Acid Dissociation Constant (pKa)
14.00
Base Dissociation Constant (pKb)
-3.81
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
0.00
Y500-6515 in Drug Discovery
Included in Screening Libraries
Crystallographic and 19F NMR fragment-libraries (624 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with Y500-6515 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)