C328-0351 Screening compound: N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide

C328-0351 Screening compound: N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide
C328-0351 Screening compound: N-({5-[({[(oxolan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C328-0351
N-({5-[({[(oxolan-2-yl)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

C328-0351

Molecular Formula

C15H18N4O4S2 (C15 H18 N4 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

O=C(CSc1nnc(CNC(c2cccs2)=O)o1)NCC1OCCC1

InChI

InChI=1S/C15H18N4O4S2/c20-12(16-7-10-3-1-5-22-10)9-25-15-19-18-13(23-15)8-17-14(21)11-4-2-6-24-11/h2,4,6,10H,1,3,5,7-9H2,(H,16,20)(H,17,21)/t10-/m1/s1

InChI Key

NPJAUEHRMVJKFQ-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD04464379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.46

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

0.117

Distribution Coefficient, logD

0.117

Water Solubility, LogSw

-2.08

Polar Surface Area

88.559

Acid Dissociation Constant (pKa)

13.30

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.70

C328-0351 in Drug Discovery

Included in Screening Libraries

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

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with C328-0351 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C328-0351?
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What is the minimum amount of C328-0351 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C328-0351
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C328-0351
  • 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 C328-0351 available by request