C328-0302 Screening compound: N-{[5-({[(2,5-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-fluorobenzamide

C328-0302 Screening compound: N-{[5-({[(2,5-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-fluorobenzamide
C328-0302 Screening compound: N-{[5-({[(2,5-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C328-0302
N-{[5-({[(2,5-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-fluorobenzamide

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

C328-0302

Molecular Formula

C20H19FN4O5S (C20 H19 FN4 O5 S)

Compound Name

N-{[5-({[(2,5-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-fluorobenzamide

IUPAC name

N-{[5-({[(25-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-134-oxadiazol-2-yl]methyl}-2-fluorobenzamide

SMILES

COc(cc1)cc(NC(CSc2nnc(CNC(c(cccc3)c3F)=O)o2)=O)c1OC

InChI

InChI=1S/C20H19FN4O5S/c1-28-12-7-8-16(29-2)15(9-12)23-17(26)11-31-20-25-24-18(30-20)10-22-19(27)13-5-3-4-6-14(13)21/h3-9H,10-11H2,1-2H3,(H,22,27)(H,23,26)

InChI Key

UZNNGTCUOMWSQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04464331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.110

Distribution Coefficient, logD

2.109

Water Solubility, LogSw

-3.20

Polar Surface Area

92.040

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

1.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C328-0302 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C328-0302 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C328-0302?
Check Price and Availability of C328-0302, 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 C328-0302 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C328-0302
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C328-0302
  • 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 C328-0302 available by request