D321-0161 Screening compound: N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide

D321-0161 Screening compound: N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide
D321-0161 Screening compound: N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D321-0161
N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide

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

D321-0161

Molecular Formula

C15H15N5O2S2 (C15 H15 N5 O2 S2)

Compound Name

N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide

IUPAC name

N-[5-(methylsulfanyl)-134-thiadiazol-2-yl]-4-(3-phenyl-124-oxadiazol-5-yl)butanamide

SMILES

CSc1nnc(NC(CCCc2nc(-c3ccccc3)no2)=O)s1

InChI

InChI=1S/C15H15N5O2S2/c1-23-15-19-18-14(24-15)16-11(21)8-5-9-12-17-13(20-22-12)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,16,18,21)

InChI Key

NLQPXWHLEINRMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14819074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.675

Distribution Coefficient, logD

3.671

Water Solubility, LogSw

-3.91

Polar Surface Area

77.365

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with D321-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D321-0161?
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What is the minimum amount of D321-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D321-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D321-0161
  • 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 D321-0161 available by request