G119-1716 Screening compound: 1-[(4-chlorophenyl)methyl]-2,3-dimethyl-N-{[4-(propan-2-yloxy)phenyl]methyl}-1H-indole-5-carboxamide

G119-1716 Screening compound: 1-[(4-chlorophenyl)methyl]-2,3-dimethyl-N-{[4-(propan-2-yloxy)phenyl]methyl}-1H-indole-5-carboxamide
G119-1716 Screening compound: 1-[(4-chlorophenyl)methyl]-2,3-dimethyl-N-{[4-(propan-2-yloxy)phenyl]methyl}-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G119-1716
1-[(4-chlorophenyl)methyl]-2,3-dimethyl-N-{[4-(propan-2-yloxy)phenyl]methyl}-1H-indole-5-carboxamide

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

G119-1716

Molecular Formula

C28H29ClN2O2 (C28 H29 ClN2 O2)

Compound Name

1-[(4-chlorophenyl)methyl]-2,3-dimethyl-N-{[4-(propan-2-yloxy)phenyl]methyl}-1H-indole-5-carboxamide

IUPAC name

1-[(4-chlorophenyl)methyl]-23-dimethyl-N-{[4-(propan-2-yloxy)phenyl]methyl}-1H-indole-5-carboxamide

SMILES

CC(C)Oc1ccc(CNC(c(cc2)cc3c2n(Cc(cc2)ccc2Cl)c(C)c3C)=O)cc1

InChI

InChI=1S/C28H29ClN2O2/c1-18(2)33-25-12-7-21(8-13-25)16-30-28(32)23-9-14-27-26(15-23)19(3)20(4)31(27)17-22-5-10-24(29)11-6-22/h5-15,18H,16-17H2,1-4H3,(H,30,32)

InChI Key

ARUWXDRUFCLHLN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14982190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.514

Distribution Coefficient, logD

6.514

Water Solubility, LogSw

-6.36

Polar Surface Area

32.655

Acid Dissociation Constant (pKa)

13.68

Base Dissociation Constant (pKb)

-3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G119-1716 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G119-1716 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G119-1716?
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What is the minimum amount of G119-1716 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G119-1716
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G119-1716
  • 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 G119-1716 available by request