SB27-0023 Screening compound: 6-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidyl}-2-oxa-6,9-diazaspiro[4.5]decan-8-one

SB27-0023 Screening compound: 6-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidyl}-2-oxa-6,9-diazaspiro[4.5]decan-8-one
SB27-0023 Screening compound: 6-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidyl}-2-oxa-6,9-diazaspiro[4.5]decan-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SB27-0023
6-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidyl}-2-oxa-6,9-diazaspiro[4.5]decan-8-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

SB27-0023

Molecular Formula

C19H31N5O2 (C19 H31 N5 O2)

Compound Name

6-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidyl}-2-oxa-6,9-diazaspiro[4.5]decan-8-one

IUPAC name

6-(1-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)-2-oxa-69-diazaspiro[4.5]decan-8-one

SMILES

CC(C)n1ncc(CN(CC2)CCC2N(C2)C3(COCC3)CNC2=O)c1

InChI

InChI=1S/C19H31N5O2/c1-15(2)24-11-16(9-21-24)10-22-6-3-17(4-7-22)23-12-18(25)20-13-19(23)5-8-26-14-19/h9,11,15,17H,3-8,10,12-14H2,1-2H3,(H,20,25)

InChI Key

JIPSGASHRHPJDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32247385

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.984

Distribution Coefficient, logD

-4.880

Water Solubility, LogSw

-1.56

Polar Surface Area

55.087

Acid Dissociation Constant (pKa)

15.09

Base Dissociation Constant (pKb)

13.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

78.95

SB27-0023 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB27-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB27-0023?
Check Price and Availability of SB27-0023, 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 SB27-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB27-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB27-0023
  • 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 SB27-0023 available by request