K783-0551 Screening compound: 2-methyl-1-(3-methylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

K783-0551 Screening compound: 2-methyl-1-(3-methylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide
K783-0551 Screening compound: 2-methyl-1-(3-methylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-0551
2-methyl-1-(3-methylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-1,3-benzodiazole-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

K783-0551

Molecular Formula

C22H26N4O2 (C22 H26 N4 O2)

Compound Name

2-methyl-1-(3-methylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

2-methyl-1-(3-methylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-13-benzodiazole-5-carboxamide

SMILES

Cc1nc(cc(cc2)C(NCCN3CCOCC3)=O)c2n1-c1cc(C)ccc1

InChI

InChI=1S/C22H26N4O2/c1-16-4-3-5-19(14-16)26-17(2)24-20-15-18(6-7-21(20)26)22(27)23-8-9-25-10-12-28-13-11-25/h3-7,14-15H,8-13H2,1-2H3,(H,23,27)

InChI Key

VVVFIFLITSJZNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15095676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.339

Distribution Coefficient, logD

2.281

Water Solubility, LogSw

-2.75

Polar Surface Area

47.833

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

K783-0551 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Targets (44014 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Epigenetics Focused Set (26518 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Immune system
Targets:
  • GPCR
  • Ion Channels
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K783-0551 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-0551?
Check Price and Availability of K783-0551, 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 K783-0551 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-0551
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-0551
  • 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 K783-0551 available by request