G336-0502 Screening compound: N-[(2-fluorophenyl)methyl]-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}piperazin-1-yl)butanamide

G336-0502 Screening compound: N-[(2-fluorophenyl)methyl]-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}piperazin-1-yl)butanamide
G336-0502 Screening compound: N-[(2-fluorophenyl)methyl]-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}piperazin-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G336-0502
N-[(2-fluorophenyl)methyl]-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}piperazin-1-yl)butanamide

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

G336-0502

Molecular Formula

C21H22FN5O2S (C21 H22 FN5 O2 S)

Compound Name

N-[(2-fluorophenyl)methyl]-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}piperazin-1-yl)butanamide

IUPAC name

N-[(2-fluorophenyl)methyl]-4-oxo-4-(4-{[13]thiazolo[54-b]pyridin-2-yl}piperazin-1-yl)butanamide

SMILES

O=C(CCC(N(CC1)CCN1c1nc2cccnc2s1)=O)NCc(cccc1)c1F

InChI

InChI=1S/C21H22FN5O2S/c22-16-5-2-1-4-15(16)14-24-18(28)7-8-19(29)26-10-12-27(13-11-26)21-25-17-6-3-9-23-20(17)30-21/h1-6,9H,7-8,10-14H2,(H,24,28)

InChI Key

QDWNTJWZNUONGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.272

Distribution Coefficient, logD

2.272

Water Solubility, LogSw

-2.58

Polar Surface Area

63.032

Acid Dissociation Constant (pKa)

12.94

Base Dissociation Constant (pKb)

8.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with G336-0502 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G336-0502?
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What is the minimum amount of G336-0502 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G336-0502
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G336-0502
  • 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 G336-0502 available by request