Y020-2605 Screening compound: 9-oxo-7-(pyrrolidin-1-yl)-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile

Y020-2605 Screening compound: 9-oxo-7-(pyrrolidin-1-yl)-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile
Y020-2605 Screening compound: 9-oxo-7-(pyrrolidin-1-yl)-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2605
9-oxo-7-(pyrrolidin-1-yl)-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile

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

Y020-2605

Molecular Formula

C13H18N4O (C13 H18 N4 O)

Compound Name

9-oxo-7-(pyrrolidin-1-yl)-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile

IUPAC name

9-oxo-7-(pyrrolidin-1-yl)-68-diazaspiro[4.5]dec-7-ene-10-carbonitrile

SMILES

N#CC(C1(CCCC1)NC(N1CCCC1)=N1)C1=O

InChI

InChI=1S/C13H18N4O/c14-9-10-11(18)15-12(17-7-3-4-8-17)16-13(10)5-1-2-6-13/h10H,1-8H2,(H,15,16,18)/t10-/m1/s1

InChI Key

GDYMKXWKPMDVRT-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD08132942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.984

Distribution Coefficient, logD

-4.009

Water Solubility, LogSw

-1.82

Polar Surface Area

56.736

Acid Dissociation Constant (pKa)

4.58

Base Dissociation Constant (pKb)

5.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

76.90

Y020-2605 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with Y020-2605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2605?
Check Price and Availability of Y020-2605, 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 Y020-2605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2605
  • 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 Y020-2605 available by request