T482-3732 Screening compound: 1-(1-methyl-1H-pyrrole-2-carbonyl)-N-{[1,2,4]triazolo[1,5-a]pyridin-8-yl}piperidin-4-amine

T482-3732 Screening compound: 1-(1-methyl-1H-pyrrole-2-carbonyl)-N-{[1,2,4]triazolo[1,5-a]pyridin-8-yl}piperidin-4-amine
T482-3732 Screening compound: 1-(1-methyl-1H-pyrrole-2-carbonyl)-N-{[1,2,4]triazolo[1,5-a]pyridin-8-yl}piperidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound T482-3732
1-(1-methyl-1H-pyrrole-2-carbonyl)-N-{[1,2,4]triazolo[1,5-a]pyridin-8-yl}piperidin-4-amine

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

T482-3732

Molecular Formula

C17H20N6O (C17 H20 N6 O)

Compound Name

1-(1-methyl-1H-pyrrole-2-carbonyl)-N-{[1,2,4]triazolo[1,5-a]pyridin-8-yl}piperidin-4-amine

IUPAC name

1-(1-methyl-1H-pyrrole-2-carbonyl)-N-{[124]triazolo[15-a]pyridin-8-yl}piperidin-4-amine

SMILES

Cn1c(C(N(CC2)CCC2Nc2cccn3ncnc23)=O)ccc1

InChI

InChI=1S/C17H20N6O/c1-21-8-3-5-15(21)17(24)22-10-6-13(7-11-22)20-14-4-2-9-23-16(14)18-12-19-23/h2-5,8-9,12-13,20H,6-7,10-11H2,1H3

InChI Key

AVTANDQJUUJIRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030341

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.579

Distribution Coefficient, logD

1.579

Water Solubility, LogSw

-1.86

Polar Surface Area

51.003

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

T482-3732 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T482-3732 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T482-3732?
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What is the minimum amount of T482-3732 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T482-3732
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T482-3732
  • 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 T482-3732 available by request