T841-2338 Screening compound: 2-(3-CHLORO-4-METHYLANILINO)-4-ETHYLPYRIDO[3,4-B]PYRAZIN-3(4H)-ONE

T841-2338 Screening compound: 2-(3-CHLORO-4-METHYLANILINO)-4-ETHYLPYRIDO[3,4-B]PYRAZIN-3(4H)-ONE
T841-2338 Screening compound: 2-(3-CHLORO-4-METHYLANILINO)-4-ETHYLPYRIDO[3,4-B]PYRAZIN-3(4H)-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound T841-2338
2-(3-CHLORO-4-METHYLANILINO)-4-ETHYLPYRIDO[3,4-B]PYRAZIN-3(4H)-ONE

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

T841-2338

Molecular Formula

C16H15ClN4O (C16 H15 ClN4 O)

Compound Name

2-(3-CHLORO-4-METHYLANILINO)-4-ETHYLPYRIDO[3,4-B]PYRAZIN-3(4H)-ONE

IUPAC name

2-[(3-chloro-4-methylphenyl)amino]-4-ethyl-3H4H-pyrido[34-b]pyrazin-3-one

SMILES

CCN(c(cncc1)c1N=C1Nc2cc(Cl)c(C)cc2)C1=O

InChI

InChI=1S/C16H15ClN4O/c1-3-21-14-9-18-7-6-13(14)20-15(16(21)22)19-11-5-4-10(2)12(17)8-11/h4-9H,3H2,1-2H3,(H,19,20)

InChI Key

VYINSOKEBKVVSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29032039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.77

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.340

Distribution Coefficient, logD

3.258

Water Solubility, LogSw

-3.44

Polar Surface Area

43.448

Acid Dissociation Constant (pKa)

8.08

Base Dissociation Constant (pKb)

4.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

T841-2338 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with T841-2338 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T841-2338?
Check Price and Availability of T841-2338, 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 T841-2338 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T841-2338
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T841-2338
  • 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 T841-2338 available by request