Y080-0383 Screening compound: methyl 2-[2-(phenoxymethyl)-1H-1,3-benzodiazol-1-yl]acetate

Y080-0383 Screening compound: methyl 2-[2-(phenoxymethyl)-1H-1,3-benzodiazol-1-yl]acetate
Y080-0383 Screening compound: methyl 2-[2-(phenoxymethyl)-1H-1,3-benzodiazol-1-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-0383
methyl 2-[2-(phenoxymethyl)-1H-1,3-benzodiazol-1-yl]acetate

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

Y080-0383

Molecular Formula

C17H16N2O3 (C17 H16 N2 O3)

Compound Name

methyl 2-[2-(phenoxymethyl)-1H-1,3-benzodiazol-1-yl]acetate

IUPAC name

methyl 2-[2-(phenoxymethyl)-1H-13-benzodiazol-1-yl]acetate

SMILES

COC(Cn1c(cccc2)c2nc1COc1ccccc1)=O

InChI

InChI=1S/C17H16N2O3/c1-21-17(20)11-19-15-10-6-5-9-14(15)18-16(19)12-22-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3

InChI Key

YKOLPEIYEKWLSP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02859168

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.005

Distribution Coefficient, logD

3.005

Water Solubility, LogSw

-3.07

Polar Surface Area

39.221

Acid Dissociation Constant (pKa)

17.47

Base Dissociation Constant (pKb)

4.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

Y080-0383 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y080-0383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-0383?
Check Price and Availability of Y080-0383, 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 Y080-0383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-0383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-0383
  • 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 Y080-0383 available by request