Y041-6244 Screening compound: N-(3-methyl-1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}butyl)-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide

Y041-6244 Screening compound: N-(3-methyl-1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}butyl)-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide
Y041-6244 Screening compound: N-(3-methyl-1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}butyl)-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-6244
N-(3-methyl-1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}butyl)-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide

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

Y041-6244

Molecular Formula

C19H24N6O (C19 H24 N6 O)

Compound Name

N-(3-methyl-1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}butyl)-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide

IUPAC name

N-[(1S)-3-methyl-1-{[124]triazolo[43-a]pyridin-3-yl}butyl]-4567-tetrahydro-2H-indazole-3-carboxamide

SMILES

CC(C)CC(c1nnc2n1cccc2)NC(c1c(CCCC2)c2n[nH]1)=O

InChI

InChI=1S/C19H24N6O/c1-12(2)11-15(18-24-22-16-9-5-6-10-25(16)18)20-19(26)17-13-7-3-4-8-14(13)21-23-17/h5-6,9-10,12,15H,3-4,7-8,11H2,1-2H3,(H,20,26)(H,21,23)/t15-/m0/s1

InChI Key

DDEWRVVNGUKEFI-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.369

Distribution Coefficient, logD

2.368

Water Solubility, LogSw

-2.60

Polar Surface Area

70.846

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

4.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.37

Y041-6244 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y041-6244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-6244?
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What is the minimum amount of Y041-6244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-6244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-6244
  • 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 Y041-6244 available by request