Y020-1864 Screening compound: 1-[2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]piperidine-4-carboxamide

Y020-1864 Screening compound: 1-[2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]piperidine-4-carboxamide
Y020-1864 Screening compound: 1-[2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1864
1-[2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]piperidine-4-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

Y020-1864

Molecular Formula

C13H19N5O2S2 (C13 H19 N5 O2 S2)

Compound Name

1-[2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]piperidine-4-carboxamide

IUPAC name

1-[2-({5-[(prop-2-en-1-yl)amino]-134-thiadiazol-2-yl}sulfanyl)acetyl]piperidine-4-carboxamide

SMILES

C=CCNc1nnc(SCC(N(CC2)CCC2C(N)=O)=O)s1

InChI

InChI=1S/C13H19N5O2S2/c1-2-5-15-12-16-17-13(22-12)21-8-10(19)18-6-3-9(4-7-18)11(14)20/h2,9H,1,3-8H2,(H2,14,20)(H,15,16)

InChI Key

CBEQQPJAZXFJCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07181627

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.639

Distribution Coefficient, logD

0.639

Water Solubility, LogSw

-1.59

Polar Surface Area

83.672

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

Y020-1864 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 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
Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Y020-1864 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1864?
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What is the minimum amount of Y020-1864 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1864
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1864
  • 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 Y020-1864 available by request