Y501-5962 Screening compound: 2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[1-methyl-2-(1H-pyrazol-1-yl)ethyl]acetamide

Y501-5962 Screening compound: 2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[1-methyl-2-(1H-pyrazol-1-yl)ethyl]acetamide
Y501-5962 Screening compound: 2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[1-methyl-2-(1H-pyrazol-1-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-5962
2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[1-methyl-2-(1H-pyrazol-1-yl)ethyl]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

Y501-5962

Molecular Formula

C17H19F3N6O (C17 H19 F3 N6 O)

Compound Name

2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[1-methyl-2-(1H-pyrazol-1-yl)ethyl]acetamide

IUPAC name

2-[36-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[34-b]pyridin-1-yl]-N-[1-(1H-pyrazol-1-yl)propan-2-yl]acetamide

SMILES

CC(Cn1nccc1)NC(Cn1nc(C)c2c(C(F)(F)F)cc(C)nc12)=O

InChI

InChI=1S/C17H19F3N6O/c1-10-7-13(17(18,19)20)15-12(3)24-26(16(15)23-10)9-14(27)22-11(2)8-25-6-4-5-21-25/h4-7,11H,8-9H2,1-3H3,(H,22,27)/t11-/m0/s1

InChI Key

UACAXMXLVXVIFK-NSHDSACASA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.461

Distribution Coefficient, logD

1.461

Water Solubility, LogSw

-2.07

Polar Surface Area

62.012

Acid Dissociation Constant (pKa)

14.86

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.18

References: we are preparing a list of scientific research reports with Y501-5962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-5962?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-5962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-5962
  • 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 Y501-5962 available by request