D073-0146 Screening compound: N-[2-(2-acetamidoethyl)-1-methyl-1H-1,3-benzodiazol-5-yl]-2-methylbenzamide

D073-0146 Screening compound: N-[2-(2-acetamidoethyl)-1-methyl-1H-1,3-benzodiazol-5-yl]-2-methylbenzamide
D073-0146 Screening compound: N-[2-(2-acetamidoethyl)-1-methyl-1H-1,3-benzodiazol-5-yl]-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D073-0146
N-[2-(2-acetamidoethyl)-1-methyl-1H-1,3-benzodiazol-5-yl]-2-methylbenzamide

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

D073-0146

Molecular Formula

C20H22N4O2 (C20 H22 N4 O2)

Compound Name

N-[2-(2-acetamidoethyl)-1-methyl-1H-1,3-benzodiazol-5-yl]-2-methylbenzamide

IUPAC name

N-[2-(2-acetamidoethyl)-1-methyl-1H-13-benzodiazol-5-yl]-2-methylbenzamide

SMILES

CC(NCCc1nc(cc(cc2)NC(c3c(C)cccc3)=O)c2n1C)=O

InChI

InChI=1S/C20H22N4O2/c1-13-6-4-5-7-16(13)20(26)22-15-8-9-18-17(12-15)23-19(24(18)3)10-11-21-14(2)25/h4-9,12H,10-11H2,1-3H3,(H,21,25)(H,22,26)

InChI Key

SUBBGFIAMJEZCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07392544

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.913

Distribution Coefficient, logD

1.908

Water Solubility, LogSw

-2.82

Polar Surface Area

59.742

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D073-0146 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with D073-0146 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D073-0146?
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What is the minimum amount of D073-0146 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D073-0146
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D073-0146
  • 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 D073-0146 available by request