F142-0175 Screening compound: 5-(1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(3-methylbutyl)pentanamide

F142-0175 Screening compound: 5-(1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(3-methylbutyl)pentanamide
F142-0175 Screening compound: 5-(1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(3-methylbutyl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F142-0175
5-(1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(3-methylbutyl)pentanamide

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

F142-0175

Molecular Formula

C27H32N4O6 (C27 H32 N4 O6)

Compound Name

5-(1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(3-methylbutyl)pentanamide

IUPAC name

5-(1-{[(2H-13-benzodioxol-5-yl)carbamoyl]methyl}-24-dioxo-1234-tetrahydroquinazolin-3-yl)-N-(3-methylbutyl)pentanamide

SMILES

CC(C)CCNC(CCCCN(C(c(cccc1)c1N1CC(Nc(cc2)cc3c2OCO3)=O)=O)C1=O)=O

InChI

InChI=1S/C27H32N4O6/c1-18(2)12-13-28-24(32)9-5-6-14-30-26(34)20-7-3-4-8-21(20)31(27(30)35)16-25(33)29-19-10-11-22-23(15-19)37-17-36-22/h3-4,7-8,10-11,15,18H,5-6,9,12-14,16-17H2,1-2H3,(H,28,32)(H,29,33)

InChI Key

FUGKJEMQEZFDPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27103821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.879

Distribution Coefficient, logD

2.879

Water Solubility, LogSw

-3.57

Polar Surface Area

96.095

Acid Dissociation Constant (pKa)

11.54

Base Dissociation Constant (pKb)

1.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

F142-0175 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with F142-0175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F142-0175?
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What is the minimum amount of F142-0175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F142-0175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F142-0175
  • 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 F142-0175 available by request