G862-0395 Screening compound: 1-(2,3-dihydro-1H-indol-1-yl)-2-({5-methoxy-2-[(pyrimidin-2-ylsulfanyl)methyl]pyridin-4-yl}oxy)ethan-1-one

G862-0395 Screening compound: 1-(2,3-dihydro-1H-indol-1-yl)-2-({5-methoxy-2-[(pyrimidin-2-ylsulfanyl)methyl]pyridin-4-yl}oxy)ethan-1-one
G862-0395 Screening compound: 1-(2,3-dihydro-1H-indol-1-yl)-2-({5-methoxy-2-[(pyrimidin-2-ylsulfanyl)methyl]pyridin-4-yl}oxy)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G862-0395
1-(2,3-dihydro-1H-indol-1-yl)-2-({5-methoxy-2-[(pyrimidin-2-ylsulfanyl)methyl]pyridin-4-yl}oxy)ethan-1-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

G862-0395

Molecular Formula

C21H20N4O3S (C21 H20 N4 O3 S)

Compound Name

1-(2,3-dihydro-1H-indol-1-yl)-2-({5-methoxy-2-[(pyrimidin-2-ylsulfanyl)methyl]pyridin-4-yl}oxy)ethan-1-one

IUPAC name

1-(23-dihydro-1H-indol-1-yl)-2-({5-methoxy-2-[(pyrimidin-2-ylsulfanyl)methyl]pyridin-4-yl}oxy)ethan-1-one

SMILES

COc1cnc(CSc2ncccn2)cc1OCC(N(CC1)c2c1cccc2)=O

InChI

InChI=1S/C21H20N4O3S/c1-27-19-12-24-16(14-29-21-22-8-4-9-23-21)11-18(19)28-13-20(26)25-10-7-15-5-2-3-6-17(15)25/h2-6,8-9,11-12H,7,10,13-14H2,1H3

InChI Key

JBOOBQIXKBCGAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15072358

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.229

Distribution Coefficient, logD

2.228

Water Solubility, LogSw

-2.45

Polar Surface Area

58.125

Acid Dissociation Constant (pKa)

21.93

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G862-0395 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G862-0395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G862-0395?
Check Price and Availability of G862-0395, 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 G862-0395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G862-0395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G862-0395
  • 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 G862-0395 available by request