G406-1311 Screening compound: 1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-(morpholine-4-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one

G406-1311 Screening compound: 1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-(morpholine-4-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one
G406-1311 Screening compound: 1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-(morpholine-4-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G406-1311
1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-(morpholine-4-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-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

G406-1311

Molecular Formula

C22H29N3O7S (C22 H29 N3 O7 S)

Compound Name

1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-(morpholine-4-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one

IUPAC name

1-(2-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-(morpholine-4-sulfonyl)-1234-tetrahydroquinolin-2-one

SMILES

O=C(CN(C(CC1)=O)c(cc2)c1cc2S(N1CCOCC1)(=O)=O)N(CC1)CCC11OCCO1

InChI

InChI=1S/C22H29N3O7S/c26-20-4-1-17-15-18(33(28,29)24-9-11-30-12-10-24)2-3-19(17)25(20)16-21(27)23-7-5-22(6-8-23)31-13-14-32-22/h2-3,15H,1,4-14,16H2

InChI Key

MVJAVKHSZWGFLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15009828

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.412

Distribution Coefficient, logD

0.412

Water Solubility, LogSw

-2.28

Polar Surface Area

86.068

Acid Dissociation Constant (pKa)

21.02

Base Dissociation Constant (pKb)

0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.60

G406-1311 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G406-1311 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G406-1311?
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What is the minimum amount of G406-1311 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G406-1311
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G406-1311
  • 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 G406-1311 available by request