C614-6130 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl}propanamide

C614-6130 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl}propanamide
C614-6130 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-6130
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl}propanamide

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

C614-6130

Molecular Formula

C23H20N4O3 (C23 H20 N4 O3)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl}propanamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-3-{3-phenyl-3H-imidazo[45-b]pyridin-2-yl}propanamide

SMILES

O=C(CCc(n1-c2ccccc2)nc2c1nccc2)Nc(cc1)cc2c1OCCO2

InChI

InChI=1S/C23H20N4O3/c28-22(25-16-8-9-19-20(15-16)30-14-13-29-19)11-10-21-26-18-7-4-12-24-23(18)27(21)17-5-2-1-3-6-17/h1-9,12,15H,10-11,13-14H2,(H,25,28)

InChI Key

FQWDEXRVMWDHES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.266

Distribution Coefficient, logD

2.266

Water Solubility, LogSw

-3.02

Polar Surface Area

60.494

Acid Dissociation Constant (pKa)

11.08

Base Dissociation Constant (pKb)

3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

C614-6130 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C614-6130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-6130?
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What is the minimum amount of C614-6130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-6130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-6130
  • 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 C614-6130 available by request