D277-1868 Screening compound: 4-methyl-2-[(2-phenoxyethyl)sulfanyl]-1H-1,3-benzodiazole

D277-1868 Screening compound: 4-methyl-2-[(2-phenoxyethyl)sulfanyl]-1H-1,3-benzodiazole
D277-1868 Screening compound: 4-methyl-2-[(2-phenoxyethyl)sulfanyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1868
4-methyl-2-[(2-phenoxyethyl)sulfanyl]-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

D277-1868

Molecular Formula

C16H16N2OS (C16 H16 N2 OS)

Compound Name

4-methyl-2-[(2-phenoxyethyl)sulfanyl]-1H-1,3-benzodiazole

IUPAC name

4-methyl-2-[(2-phenoxyethyl)sulfanyl]-1H-13-benzodiazole

SMILES

Cc1cccc([nH]2)c1nc2SCCOc1ccccc1

InChI

InChI=1S/C16H16N2OS/c1-12-6-5-9-14-15(12)18-16(17-14)20-11-10-19-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,17,18)

InChI Key

SKYWPKCUOKDXRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08361966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.38

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.820

Distribution Coefficient, logD

3.786

Water Solubility, LogSw

-3.99

Polar Surface Area

26.168

Acid Dissociation Constant (pKa)

13.28

Base Dissociation Constant (pKb)

6.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

D277-1868 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D277-1868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1868?
Check Price and Availability of D277-1868, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D277-1868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1868
  • 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 D277-1868 available by request