K979-0317 Screening compound: ethyl 4-{2-[2-(4-oxo-3,4-dihydroquinazolin-3-yl)acetamido]acetyl}piperazine-1-carboxylate

K979-0317 Screening compound: ethyl 4-{2-[2-(4-oxo-3,4-dihydroquinazolin-3-yl)acetamido]acetyl}piperazine-1-carboxylate
K979-0317 Screening compound: ethyl 4-{2-[2-(4-oxo-3,4-dihydroquinazolin-3-yl)acetamido]acetyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K979-0317
ethyl 4-{2-[2-(4-oxo-3,4-dihydroquinazolin-3-yl)acetamido]acetyl}piperazine-1-carboxylate

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

K979-0317

Molecular Formula

C19H23N5O5 (C19 H23 N5 O5)

Compound Name

ethyl 4-{2-[2-(4-oxo-3,4-dihydroquinazolin-3-yl)acetamido]acetyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{2-[2-(4-oxo-34-dihydroquinazolin-3-yl)acetamido]acetyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(CNC(CN(C=Nc1c2cccc1)C2=O)=O)=O)=O

InChI

InChI=1S/C19H23N5O5/c1-2-29-19(28)23-9-7-22(8-10-23)17(26)11-20-16(25)12-24-13-21-15-6-4-3-5-14(15)18(24)27/h3-6,13H,2,7-12H2,1H3,(H,20,25)

InChI Key

QPOIVQFMTCHPCR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115783

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.234

Distribution Coefficient, logD

-0.234

Water Solubility, LogSw

-2.45

Polar Surface Area

89.983

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

K979-0317 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with K979-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K979-0317?
Check Price and Availability of K979-0317, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K979-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K979-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K979-0317
  • 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 K979-0317 available by request