G642-5807 Screening compound: 1-[5-(4-chloro-3-nitrophenyl)-2-(3-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one

G642-5807 Screening compound: 1-[5-(4-chloro-3-nitrophenyl)-2-(3-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one
G642-5807 Screening compound: 1-[5-(4-chloro-3-nitrophenyl)-2-(3-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-5807
1-[5-(4-chloro-3-nitrophenyl)-2-(3-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one

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

G642-5807

Molecular Formula

C16H11Cl2N3O4 (C16 H11 Cl2 N3 O4)

Compound Name

1-[5-(4-chloro-3-nitrophenyl)-2-(3-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one

IUPAC name

1-[5-(4-chloro-3-nitrophenyl)-2-(3-chlorophenyl)-23-dihydro-134-oxadiazol-3-yl]ethan-1-one

SMILES

CC(N1N=C(c(cc2)cc([N+]([O-])=O)c2Cl)OC1c1cc(Cl)ccc1)=O

InChI

InChI=1S/C16H11Cl2N3O4/c1-9(22)20-16(11-3-2-4-12(17)7-11)25-15(19-20)10-5-6-13(18)14(8-10)21(23)24/h2-8,16H,1H3/t16-/m1/s1

InChI Key

BBFROJMNKRNBBW-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD15025458

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.19

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.057

Distribution Coefficient, logD

4.057

Water Solubility, LogSw

-4.40

Polar Surface Area

68.332

Acid Dissociation Constant (pKa)

23.45

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with G642-5807 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-5807?
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What is the minimum amount of G642-5807 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-5807
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-5807
  • 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 G642-5807 available by request