G883-0206 Screening compound: 4-(azepan-1-yl)-4-oxo-N-[(1-propanoyl-2,3-dihydro-1H-indol-5-yl)methyl]butanamide

G883-0206 Screening compound: 4-(azepan-1-yl)-4-oxo-N-[(1-propanoyl-2,3-dihydro-1H-indol-5-yl)methyl]butanamide
G883-0206 Screening compound: 4-(azepan-1-yl)-4-oxo-N-[(1-propanoyl-2,3-dihydro-1H-indol-5-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G883-0206
4-(azepan-1-yl)-4-oxo-N-[(1-propanoyl-2,3-dihydro-1H-indol-5-yl)methyl]butanamide

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

G883-0206

Molecular Formula

C22H31N3O3 (C22 H31 N3 O3)

Compound Name

4-(azepan-1-yl)-4-oxo-N-[(1-propanoyl-2,3-dihydro-1H-indol-5-yl)methyl]butanamide

IUPAC name

4-(azepan-1-yl)-4-oxo-N-[(1-propanoyl-23-dihydro-1H-indol-5-yl)methyl]butanamide

SMILES

CCC(N(CC1)c2c1cc(CNC(CCC(N1CCCCCC1)=O)=O)cc2)=O

InChI

InChI=1S/C22H31N3O3/c1-2-21(27)25-14-11-18-15-17(7-8-19(18)25)16-23-20(26)9-10-22(28)24-12-5-3-4-6-13-24/h7-8,15H,2-6,9-14,16H2,1H3,(H,23,26)

InChI Key

PLPKZHLDDNBROH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27165307

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.903

Distribution Coefficient, logD

1.903

Water Solubility, LogSw

-2.55

Polar Surface Area

56.585

Acid Dissociation Constant (pKa)

13.81

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.10

G883-0206 in Drug Discovery

Included in Screening Libraries

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

Adenosine Receptors Targeted Library (19896 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Cancer
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with G883-0206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G883-0206?
Check Price and Availability of G883-0206, 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 G883-0206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G883-0206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G883-0206
  • 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 G883-0206 available by request