G940-0477 Screening compound: 8-[1-(pyridine-3-sulfonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

G940-0477 Screening compound: 8-[1-(pyridine-3-sulfonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane
G940-0477 Screening compound: 8-[1-(pyridine-3-sulfonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound G940-0477
8-[1-(pyridine-3-sulfonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

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

G940-0477

Molecular Formula

C18H25N3O5S (C18 H25 N3 O5 S)

Compound Name

8-[1-(pyridine-3-sulfonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-[1-(pyridine-3-sulfonyl)piperidine-4-carbonyl]-14-dioxa-8-azaspiro[4.5]decane

SMILES

O=C(C(CC1)CCN1S(c1cnccc1)(=O)=O)N(CC1)CCC11OCCO1

InChI

InChI=1S/C18H25N3O5S/c22-17(20-10-5-18(6-11-20)25-12-13-26-18)15-3-8-21(9-4-15)27(23,24)16-2-1-7-19-14-16/h1-2,7,14-15H,3-6,8-13H2

InChI Key

WZCGWWAMIRSHNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15076425

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.273

Distribution Coefficient, logD

0.273

Water Solubility, LogSw

-1.44

Polar Surface Area

72.552

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

G940-0477 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G940-0477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G940-0477?
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What is the minimum amount of G940-0477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G940-0477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G940-0477
  • 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 G940-0477 available by request