D277-1873 Screening compound: 2-(benzylsulfanyl)-4-methyl-1H-1,3-benzodiazole

D277-1873 Screening compound: 2-(benzylsulfanyl)-4-methyl-1H-1,3-benzodiazole
D277-1873 Screening compound: 2-(benzylsulfanyl)-4-methyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1873
2-(benzylsulfanyl)-4-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

D277-1873

Molecular Formula

C15H14N2S (C15 H14 N2 S)

Compound Name

2-(benzylsulfanyl)-4-methyl-1H-1,3-benzodiazole

IUPAC name

2-(benzylsulfanyl)-4-methyl-1H-13-benzodiazole

SMILES

Cc1cccc([nH]2)c1nc2SCc1ccccc1

InChI

InChI=1S/C15H14N2S/c1-11-6-5-9-13-14(11)17-15(16-13)18-10-12-7-3-2-4-8-12/h2-9H,10H2,1H3,(H,16,17)

InChI Key

JXPFZSMHXJYPEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08361963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

254.36

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.596

Distribution Coefficient, logD

3.344

Water Solubility, LogSw

-3.62

Polar Surface Area

18.750

Acid Dissociation Constant (pKa)

13.52

Base Dissociation Constant (pKb)

7.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

D277-1873 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D277-1873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1873?
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What is the minimum amount of D277-1873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1873
  • 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 D277-1873 available by request