D523-1728 Screening compound: 6-chloro-7-methyl-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-chromene-2-carboxamide

D523-1728 Screening compound: 6-chloro-7-methyl-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-chromene-2-carboxamide
D523-1728 Screening compound: 6-chloro-7-methyl-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D523-1728
6-chloro-7-methyl-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-chromene-2-carboxamide

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

D523-1728

Molecular Formula

C21H16ClN3O4 (C21 H16 ClN3 O4)

Compound Name

6-chloro-7-methyl-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-chromene-2-carboxamide

IUPAC name

6-chloro-7-methyl-4-oxo-N-[2-(3-phenyl-124-oxadiazol-5-yl)ethyl]-4H-chromene-2-carboxamide

SMILES

Cc(cc(c1c2)OC(C(NCCc3nc(-c4ccccc4)no3)=O)=CC1=O)c2Cl

InChI

InChI=1S/C21H16ClN3O4/c1-12-9-17-14(10-15(12)22)16(26)11-18(28-17)21(27)23-8-7-19-24-20(25-29-19)13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3,(H,23,27)

InChI Key

WNXFGPGISKXQNC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.996

Distribution Coefficient, logD

4.996

Water Solubility, LogSw

-5.16

Polar Surface Area

77.655

Acid Dissociation Constant (pKa)

13.21

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

D523-1728 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with D523-1728 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D523-1728?
Check Price and Availability of D523-1728, 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 D523-1728 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D523-1728
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D523-1728
  • 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 D523-1728 available by request