K788-4299 Screening compound: N-(2,3-dimethylphenyl)-2-(3-formyl-1H-indol-1-yl)acetamide

K788-4299 Screening compound: N-(2,3-dimethylphenyl)-2-(3-formyl-1H-indol-1-yl)acetamide
K788-4299 Screening compound: N-(2,3-dimethylphenyl)-2-(3-formyl-1H-indol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-4299
N-(2,3-dimethylphenyl)-2-(3-formyl-1H-indol-1-yl)acetamide

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

K788-4299

Molecular Formula

C19H18N2O2 (C19 H18 N2 O2)

Compound Name

N-(2,3-dimethylphenyl)-2-(3-formyl-1H-indol-1-yl)acetamide

IUPAC name

N-(23-dimethylphenyl)-2-(3-formyl-1H-indol-1-yl)acetamide

SMILES

Cc1cccc(NC(Cn2c(cccc3)c3c(C=O)c2)=O)c1C

InChI

InChI=1S/C19H18N2O2/c1-13-6-5-8-17(14(13)2)20-19(23)11-21-10-15(12-22)16-7-3-4-9-18(16)21/h3-10,12H,11H2,1-2H3,(H,20,23)

InChI Key

GEGQITSCOIWVEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03083299

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.572

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-3.42

Polar Surface Area

38.581

Acid Dissociation Constant (pKa)

12.32

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

K788-4299 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with K788-4299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-4299?
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What is the minimum amount of K788-4299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-4299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-4299
  • 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 K788-4299 available by request