C328-0226 Screening compound: 2-chloro-6-fluoro-N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)benzamide

C328-0226 Screening compound: 2-chloro-6-fluoro-N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)benzamide
C328-0226 Screening compound: 2-chloro-6-fluoro-N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C328-0226
2-chloro-6-fluoro-N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)benzamide

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

C328-0226

Molecular Formula

C17H18ClFN4O4S (C17 H18 ClFN4 O4 S)

Compound Name

2-chloro-6-fluoro-N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)benzamide

IUPAC name

2-chloro-6-fluoro-N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-134-oxadiazol-2-yl}methyl)benzamide

SMILES

O=C(CSc1nnc(CNC(c(c(F)ccc2)c2Cl)=O)o1)NCC1OCCC1

InChI

InChI=1S/C17H18ClFN4O4S/c18-11-4-1-5-12(19)15(11)16(25)21-8-14-22-23-17(27-14)28-9-13(24)20-7-10-3-2-6-26-10/h1,4-5,10H,2-3,6-9H2,(H,20,24)(H,21,25)/t10-/m1/s1

InChI Key

OLYKVNNQMKJXMQ-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD04464260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.87

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.739

Distribution Coefficient, logD

0.739

Water Solubility, LogSw

-2.85

Polar Surface Area

87.540

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with C328-0226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C328-0226?
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What is the minimum amount of C328-0226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C328-0226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C328-0226
  • 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 C328-0226 available by request