T475-0994 Screening compound: 4-(2-methylpropyl)-3-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide

T475-0994 Screening compound: 4-(2-methylpropyl)-3-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide
T475-0994 Screening compound: 4-(2-methylpropyl)-3-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T475-0994
4-(2-methylpropyl)-3-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-3H,4H-pyrido[2,3-b]pyrazine-2-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

T475-0994

Molecular Formula

C20H19F3N4O2 (C20 H19 F3 N4 O2)

Compound Name

4-(2-methylpropyl)-3-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide

IUPAC name

4-(2-methylpropyl)-3-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-3H4H-pyrido[23-b]pyrazine-2-carboxamide

SMILES

CC(C)CN(c(nccc1)c1N=C1C(NCc2c(C(F)(F)F)cccc2)=O)C1=O

InChI

InChI=1S/C20H19F3N4O2/c1-12(2)11-27-17-15(8-5-9-24-17)26-16(19(27)29)18(28)25-10-13-6-3-4-7-14(13)20(21,22)23/h3-9,12H,10-11H2,1-2H3,(H,25,28)

InChI Key

ZPIBUFJFXXLYHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27621526

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.457

Distribution Coefficient, logD

3.456

Water Solubility, LogSw

-3.72

Polar Surface Area

58.465

Acid Dissociation Constant (pKa)

10.22

Base Dissociation Constant (pKb)

-3.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

T475-0994 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with T475-0994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T475-0994?
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What is the minimum amount of T475-0994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T475-0994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T475-0994
  • 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 T475-0994 available by request