Y503-1951 Screening compound: 2-[5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][1,2,4]triazolo[1,5-c]quinazoline

Y503-1951 Screening compound: 2-[5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][1,2,4]triazolo[1,5-c]quinazoline
Y503-1951 Screening compound: 2-[5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][1,2,4]triazolo[1,5-c]quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound Y503-1951
2-[5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][1,2,4]triazolo[1,5-c]quinazoline

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

Y503-1951

Molecular Formula

C23H18F3N7O (C23 H18 F3 N7 O)

Compound Name

2-[5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][1,2,4]triazolo[1,5-c]quinazoline

IUPAC name

5-(4-methoxyphenyl)-3-{[124]triazolo[15-c]quinazolin-2-yl}-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine

SMILES

COc1ccc(C(CC(C(F)(F)F)n2nc3)Nc2c3-c2nn(cnc3c4cccc3)c4n2)cc1

InChI

InChI=1S/C23H18F3N7O/c1-34-14-8-6-13(7-9-14)18-10-19(23(24,25)26)33-22(29-18)16(11-28-33)20-30-21-15-4-2-3-5-17(15)27-12-32(21)31-20/h2-9,11-12,18-19,29H,10H2,1H3

InChI Key

XKTKDODOXKZMAM-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.330

Distribution Coefficient, logD

4.327

Water Solubility, LogSw

-4.31

Polar Surface Area

62.549

Acid Dissociation Constant (pKa)

19.29

Base Dissociation Constant (pKb)

5.31

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

21.74

References: we are preparing a list of scientific research reports with Y503-1951 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y503-1951?
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What is the minimum amount of Y503-1951 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y503-1951
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y503-1951
  • 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 Y503-1951 available by request