8017-2773 Screening compound: N~1~-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-phenylpropanamide

8017-2773 Screening compound: N~1~-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-phenylpropanamide
8017-2773 Screening compound: N~1~-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-2773
N~1~-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-phenylpropanamide

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

8017-2773

Molecular Formula

C23H17Cl2N3O2 (C23 H17 Cl2 N3 O2)

Compound Name

N~1~-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-phenylpropanamide

IUPAC name

N-{2-[5-(34-dichlorophenyl)-134-oxadiazol-2-yl]phenyl}-3-phenylpropanamide

SMILES

O=C(CCc1ccccc1)Nc(cccc1)c1-c1nnc(-c(cc2)cc(Cl)c2Cl)o1

InChI

InChI=1S/C23H17Cl2N3O2/c24-18-12-11-16(14-19(18)25)22-27-28-23(30-22)17-8-4-5-9-20(17)26-21(29)13-10-15-6-2-1-3-7-15/h1-9,11-12,14H,10,13H2,(H,26,29)

InChI Key

ZEHFAEBEPZPIGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06015545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.554

Distribution Coefficient, logD

5.554

Water Solubility, LogSw

-5.92

Polar Surface Area

52.662

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

8017-2773 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8017-2773 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-2773?
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What is the minimum amount of 8017-2773 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-2773
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-2773
  • 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 8017-2773 available by request