D360-5952 Screening compound: propan-2-yl 2-({3-cyano-5H,6H,7H-cyclopenta[b]pyridin-2-yl}sulfanyl)acetate

D360-5952 Screening compound: propan-2-yl 2-({3-cyano-5H,6H,7H-cyclopenta[b]pyridin-2-yl}sulfanyl)acetate
D360-5952 Screening compound: propan-2-yl 2-({3-cyano-5H,6H,7H-cyclopenta[b]pyridin-2-yl}sulfanyl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound D360-5952
propan-2-yl 2-({3-cyano-5H,6H,7H-cyclopenta[b]pyridin-2-yl}sulfanyl)acetate

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

D360-5952

Molecular Formula

C14H16N2O2S (C14 H16 N2 O2 S)

Compound Name

propan-2-yl 2-({3-cyano-5H,6H,7H-cyclopenta[b]pyridin-2-yl}sulfanyl)acetate

IUPAC name

propan-2-yl 2-({3-cyano-5H6H7H-cyclopenta[b]pyridin-2-yl}sulfanyl)acetate

SMILES

CC(C)OC(CSc1nc(CCC2)c2cc1C#N)=O

InChI

InChI=1S/C14H16N2O2S/c1-9(2)18-13(17)8-19-14-11(7-15)6-10-4-3-5-12(10)16-14/h6,9H,3-5,8H2,1-2H3

InChI Key

GNSYNSFEZGMUIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14824586

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.028

Distribution Coefficient, logD

3.028

Water Solubility, LogSw

-3.24

Polar Surface Area

47.667

Acid Dissociation Constant (pKa)

17.91

Base Dissociation Constant (pKb)

2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

D360-5952 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 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 D360-5952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D360-5952?
Check Price and Availability of D360-5952, 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 D360-5952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D360-5952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D360-5952
  • 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 D360-5952 available by request