C200-5000 Screening compound: 3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-chromen-8-yl propanoate

C200-5000 Screening compound: 3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-chromen-8-yl propanoate
C200-5000 Screening compound: 3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-chromen-8-yl propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-5000
3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-chromen-8-yl propanoate

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

C200-5000

Molecular Formula

C21H16N2O5 (C21 H16 N2 O5)

Compound Name

3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-chromen-8-yl propanoate

IUPAC name

3-[3-(2-methylphenyl)-124-oxadiazol-5-yl]-2-oxo-2H-chromen-8-yl propanoate

SMILES

CCC(Oc(cccc1C=C2c3nc(-c4c(C)cccc4)no3)c1OC2=O)=O

InChI

InChI=1S/C21H16N2O5/c1-3-17(24)26-16-10-6-8-13-11-15(21(25)27-18(13)16)20-22-19(23-28-20)14-9-5-4-7-12(14)2/h4-11H,3H2,1-2H3

InChI Key

YXDOFQWNQLRGPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14727692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.254

Distribution Coefficient, logD

4.254

Water Solubility, LogSw

-4.51

Polar Surface Area

72.391

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

-11.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

C200-5000 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 C200-5000 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-5000?
Check Price and Availability of C200-5000, 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 C200-5000 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-5000
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-5000
  • 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 C200-5000 available by request