Y020-1986 Screening compound: 1-{2-[(6-methoxy-4-methylquinazolin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide

Y020-1986 Screening compound: 1-{2-[(6-methoxy-4-methylquinazolin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
Y020-1986 Screening compound: 1-{2-[(6-methoxy-4-methylquinazolin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1986
1-{2-[(6-methoxy-4-methylquinazolin-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

Y020-1986

Molecular Formula

C18H22N4O3S (C18 H22 N4 O3 S)

Compound Name

1-{2-[(6-methoxy-4-methylquinazolin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide

IUPAC name

1-{2-[(6-methoxy-4-methylquinazolin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide

SMILES

Cc(c1c2)nc(SCC(N(CC3)CCC3C(N)=O)=O)nc1ccc2OC

InChI

InChI=1S/C18H22N4O3S/c1-11-14-9-13(25-2)3-4-15(14)21-18(20-11)26-10-16(23)22-7-5-12(6-8-22)17(19)24/h3-4,9,12H,5-8,10H2,1-2H3,(H2,19,24)

InChI Key

XASGYRGBURPRQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08088210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.540

Distribution Coefficient, logD

1.540

Water Solubility, LogSw

-2.36

Polar Surface Area

75.547

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

Y020-1986 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with Y020-1986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1986?
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What is the minimum amount of Y020-1986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1986
  • 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 Y020-1986 available by request