J061-2331 Screening compound: 3-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)propanamide

J061-2331 Screening compound: 3-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)propanamide
J061-2331 Screening compound: 3-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J061-2331
3-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)propanamide

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

J061-2331

Molecular Formula

C17H17N3O2S (C17 H17 N3 O2 S)

Compound Name

3-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)propanamide

IUPAC name

3-({5-methyl-[13]oxazolo[45-b]pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)propanamide

SMILES

Cc1cccc(NC(CCSc2nc(nc(C)cc3)c3o2)=O)c1

InChI

InChI=1S/C17H17N3O2S/c1-11-4-3-5-13(10-11)19-15(21)8-9-23-17-20-16-14(22-17)7-6-12(2)18-16/h3-7,10H,8-9H2,1-2H3,(H,19,21)

InChI Key

TZDHDHJJHFQTID-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15079874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.732

Distribution Coefficient, logD

3.732

Water Solubility, LogSw

-3.74

Polar Surface Area

49.528

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

3.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with J061-2331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J061-2331?
Check Price and Availability of J061-2331, 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 J061-2331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J061-2331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J061-2331
  • 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 J061-2331 available by request