G119-1199 Screening compound: 8-(1-benzyl-2,3-dimethyl-1H-indole-5-carbonyl)-1,4-dioxa-8-azaspiro[4.5]decane

G119-1199 Screening compound: 8-(1-benzyl-2,3-dimethyl-1H-indole-5-carbonyl)-1,4-dioxa-8-azaspiro[4.5]decane
G119-1199 Screening compound: 8-(1-benzyl-2,3-dimethyl-1H-indole-5-carbonyl)-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound G119-1199
8-(1-benzyl-2,3-dimethyl-1H-indole-5-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

G119-1199

Molecular Formula

C25H28N2O3 (C25 H28 N2 O3)

Compound Name

8-(1-benzyl-2,3-dimethyl-1H-indole-5-carbonyl)-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-(1-benzyl-23-dimethyl-1H-indole-5-carbonyl)-14-dioxa-8-azaspiro[4.5]decane

SMILES

Cc1c(C)n(Cc2ccccc2)c(cc2)c1cc2C(N(CC1)CCC11OCCO1)=O

InChI

InChI=1S/C25H28N2O3/c1-18-19(2)27(17-20-6-4-3-5-7-20)23-9-8-21(16-22(18)23)24(28)26-12-10-25(11-13-26)29-14-15-30-25/h3-9,16H,10-15,17H2,1-2H3

InChI Key

ZGKYMGPXJWGUDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14982032

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.646

Distribution Coefficient, logD

3.646

Water Solubility, LogSw

-4.01

Polar Surface Area

32.524

Acid Dissociation Constant (pKa)

26.90

Base Dissociation Constant (pKb)

-0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

G119-1199 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G119-1199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G119-1199?
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What is the minimum amount of G119-1199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G119-1199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G119-1199
  • 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 G119-1199 available by request