D073-0196 Screening compound: 2-methyl-N-{1-methyl-2-[2-(phenylformamido)ethyl]-1H-1,3-benzodiazol-5-yl}benzamide

D073-0196 Screening compound: 2-methyl-N-{1-methyl-2-[2-(phenylformamido)ethyl]-1H-1,3-benzodiazol-5-yl}benzamide
D073-0196 Screening compound: 2-methyl-N-{1-methyl-2-[2-(phenylformamido)ethyl]-1H-1,3-benzodiazol-5-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D073-0196
2-methyl-N-{1-methyl-2-[2-(phenylformamido)ethyl]-1H-1,3-benzodiazol-5-yl}benzamide

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

D073-0196

Molecular Formula

C25H24N4O2 (C25 H24 N4 O2)

Compound Name

2-methyl-N-{1-methyl-2-[2-(phenylformamido)ethyl]-1H-1,3-benzodiazol-5-yl}benzamide

IUPAC name

2-methyl-N-{1-methyl-2-[2-(phenylformamido)ethyl]-1H-13-benzodiazol-5-yl}benzamide

SMILES

Cc(cccc1)c1C(Nc(cc1)cc2c1n(C)c(CCNC(c1ccccc1)=O)n2)=O

InChI

InChI=1S/C25H24N4O2/c1-17-8-6-7-11-20(17)25(31)27-19-12-13-22-21(16-19)28-23(29(22)2)14-15-26-24(30)18-9-4-3-5-10-18/h3-13,16H,14-15H2,1-2H3,(H,26,30)(H,27,31)

InChI Key

KQNVRMMUPAJOPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08286172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.533

Distribution Coefficient, logD

3.532

Water Solubility, LogSw

-3.83

Polar Surface Area

59.571

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

D073-0196 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D073-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D073-0196?
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What is the minimum amount of D073-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D073-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D073-0196
  • 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 D073-0196 available by request