C328-0365 Screening compound: N-({5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide

C328-0365 Screening compound: N-({5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide
C328-0365 Screening compound: N-({5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C328-0365
N-({5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-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

C328-0365

Molecular Formula

C17H15FN4O3S2 (C17 H15 FN4 O3 S2)

Compound Name

N-({5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide

IUPAC name

N-({5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-134-oxadiazol-2-yl}methyl)thiophene-2-carboxamide

SMILES

O=C(CSc1nnc(CNC(c2cccs2)=O)o1)NCc(cc1)ccc1F

InChI

InChI=1S/C17H15FN4O3S2/c18-12-5-3-11(4-6-12)8-19-14(23)10-27-17-22-21-15(25-17)9-20-16(24)13-2-1-7-26-13/h1-7H,8-10H2,(H,19,23)(H,20,24)

InChI Key

NFPRFKQNURSGLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04464393

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.691

Distribution Coefficient, logD

1.691

Water Solubility, LogSw

-2.29

Polar Surface Area

79.904

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

C328-0365 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C328-0365 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C328-0365?
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What is the minimum amount of C328-0365 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C328-0365
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C328-0365
  • 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 C328-0365 available by request