2198-3996 Screening compound: 4,6-dimethyl-2-[(4-methylphenyl)amino]pyridine-3-carboxamide

2198-3996 Screening compound: 4,6-dimethyl-2-[(4-methylphenyl)amino]pyridine-3-carboxamide
2198-3996 Screening compound: 4,6-dimethyl-2-[(4-methylphenyl)amino]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2198-3996
4,6-dimethyl-2-[(4-methylphenyl)amino]pyridine-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

2198-3996

Molecular Formula

C15H17N3O (C15 H17 N3 O)

Compound Name

4,6-dimethyl-2-[(4-methylphenyl)amino]pyridine-3-carboxamide

IUPAC name

46-dimethyl-2-[(4-methylphenyl)amino]pyridine-3-carboxamide

SMILES

Cc(cc1)ccc1Nc1c(C(N)=O)c(C)cc(C)n1

InChI

InChI=1S/C15H17N3O/c1-9-4-6-12(7-5-9)18-15-13(14(16)19)10(2)8-11(3)17-15/h4-8H,1-3H3,(H2,16,19)(H,17,18)

InChI Key

POVASVWFMVBKHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01622955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

255.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.029

Distribution Coefficient, logD

2.005

Water Solubility, LogSw

-2.72

Polar Surface Area

52.272

Acid Dissociation Constant (pKa)

14.35

Base Dissociation Constant (pKb)

6.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

2198-3996 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2198-3996 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2198-3996?
Check Price and Availability of 2198-3996, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 2198-3996 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2198-3996
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2198-3996
  • 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 2198-3996 available by request