Y504-7899 Screening compound: 3-(3,4-dichlorophenyl)-6-(1,5-dimethyl-1H-pyrazol-4-yl)-4-(trifluoromethyl)isoxazolo[5,4-b]pyridine

Y504-7899 Screening compound: 3-(3,4-dichlorophenyl)-6-(1,5-dimethyl-1H-pyrazol-4-yl)-4-(trifluoromethyl)isoxazolo[5,4-b]pyridine
Y504-7899 Screening compound: 3-(3,4-dichlorophenyl)-6-(1,5-dimethyl-1H-pyrazol-4-yl)-4-(trifluoromethyl)isoxazolo[5,4-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y504-7899
3-(3,4-dichlorophenyl)-6-(1,5-dimethyl-1H-pyrazol-4-yl)-4-(trifluoromethyl)isoxazolo[5,4-b]pyridine

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

Y504-7899

Molecular Formula

C18H11Cl2F3N4O (C18 H11 Cl2 F3 N4 O)

Compound Name

3-(3,4-dichlorophenyl)-6-(1,5-dimethyl-1H-pyrazol-4-yl)-4-(trifluoromethyl)isoxazolo[5,4-b]pyridine

IUPAC name

4-[3-(34-dichlorophenyl)-4-(trifluoromethyl)-[12]oxazolo[54-b]pyridin-6-yl]-15-dimethyl-1H-pyrazole

SMILES

Cc(n(C)nc1)c1-c1cc(C(F)(F)F)c(c(-c(cc2)cc(Cl)c2Cl)no2)c2n1

InChI

InChI=1S/C18H11Cl2F3N4O/c1-8-10(7-24-27(8)2)14-6-11(18(21,22)23)15-16(26-28-17(15)25-14)9-3-4-12(19)13(20)5-9/h3-7H,1-2H3

InChI Key

JGMXYCRVJDHNHG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.21

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.585

Distribution Coefficient, logD

5.585

Water Solubility, LogSw

-6.16

Polar Surface Area

45.170

Acid Dissociation Constant (pKa)

27.60

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

References: we are preparing a list of scientific research reports with Y504-7899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y504-7899?
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What is the minimum amount of Y504-7899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y504-7899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y504-7899
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y504-7899 available by request