C301-5969 Screening compound: 4-chloro-N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]benzamide

C301-5969 Screening compound: 4-chloro-N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]benzamide
C301-5969 Screening compound: 4-chloro-N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5969
4-chloro-N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-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

C301-5969

Molecular Formula

C21H23ClN4O2 (C21 H23 ClN4 O2)

Compound Name

4-chloro-N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]benzamide

IUPAC name

4-chloro-N-[13-dimethyl-2-oxo-6-(piperidin-1-yl)-23-dihydro-1H-13-benzodiazol-5-yl]benzamide

SMILES

CN(c(c(N1C)c2)cc(NC(c(cc3)ccc3Cl)=O)c2N2CCCCC2)C1=O

InChI

InChI=1S/C21H23ClN4O2/c1-24-18-12-16(23-20(27)14-6-8-15(22)9-7-14)17(26-10-4-3-5-11-26)13-19(18)25(2)21(24)28/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,23,27)

InChI Key

GZZKZPFURWWWJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14744208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.472

Distribution Coefficient, logD

3.372

Water Solubility, LogSw

-4.64

Polar Surface Area

43.468

Acid Dissociation Constant (pKa)

6.34

Base Dissociation Constant (pKb)

9.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C301-5969 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C301-5969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5969?
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What is the minimum amount of C301-5969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5969
  • 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 C301-5969 available by request