D347-1319 Screening compound: 5,6-dimethyl-2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1H-1,3-benzodiazole

D347-1319 Screening compound: 5,6-dimethyl-2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1H-1,3-benzodiazole
D347-1319 Screening compound: 5,6-dimethyl-2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-1319
5,6-dimethyl-2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1H-1,3-benzodiazole

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

D347-1319

Molecular Formula

C19H20N2O (C19 H20 N2 O)

Compound Name

5,6-dimethyl-2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1H-1,3-benzodiazole

IUPAC name

56-dimethyl-2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-1H-13-benzodiazole

SMILES

Cc(c(C)c1)cc2c1nc(COc1c(CC=C)cccc1)[nH]2

InChI

InChI=1S/C19H20N2O/c1-4-7-15-8-5-6-9-18(15)22-12-19-20-16-10-13(2)14(3)11-17(16)21-19/h4-6,8-11H,1,7,12H2,2-3H3,(H,20,21)

InChI Key

IVXZZQKEBLHNHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12548407

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.503

Distribution Coefficient, logD

5.502

Water Solubility, LogSw

-5.53

Polar Surface Area

27.834

Acid Dissociation Constant (pKa)

12.32

Base Dissociation Constant (pKb)

4.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D347-1319 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D347-1319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-1319?
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What is the minimum amount of D347-1319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-1319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-1319
  • 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 D347-1319 available by request