Y507-3389 Screening compound: ethyl 2-{[4-(4-chlorophenyl)-6-(difluoromethyl)-2-pyrimidinyl]sulfanyl}acetate
Chemical Structure Depiction of ChemDiv screening compound Y507-3389
ethyl 2-{[4-(4-chlorophenyl)-6-(difluoromethyl)-2-pyrimidinyl]sulfanyl}acetate
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
Y507-3389
Molecular Formula
C15H13ClF2N2O2S (C15 H13 ClF2 N2 O2 S)
Compound Name
ethyl 2-{[4-(4-chlorophenyl)-6-(difluoromethyl)-2-pyrimidinyl]sulfanyl}acetate
IUPAC name
n/a
SMILES
CCOC(CSc1nc(C(F)F)cc(-c(cc2)ccc2Cl)n1)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
358.8
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.572
Distribution Coefficient, logD
4.572
Water Solubility, LogSw
-4.74
Polar Surface Area
37.419
Acid Dissociation Constant (pKa)
17.45
Base Dissociation Constant (pKb)
2.49
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.70
References: we are preparing a list of scientific research reports with Y507-3389 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)