M381-2996 Screening compound: (2E)-3-(furan-2-yl)-N-[4-(piperidin-1-yl)quinazolin-6-yl]prop-2-enamide

M381-2996 Screening compound: (2E)-3-(furan-2-yl)-N-[4-(piperidin-1-yl)quinazolin-6-yl]prop-2-enamide
M381-2996 Screening compound: (2E)-3-(furan-2-yl)-N-[4-(piperidin-1-yl)quinazolin-6-yl]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M381-2996
(2E)-3-(furan-2-yl)-N-[4-(piperidin-1-yl)quinazolin-6-yl]prop-2-enamide

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

M381-2996

Molecular Formula

C20H20N4O2 (C20 H20 N4 O2)

Compound Name

(2E)-3-(furan-2-yl)-N-[4-(piperidin-1-yl)quinazolin-6-yl]prop-2-enamide

IUPAC name

(2E)-3-(furan-2-yl)-N-[4-(piperidin-1-yl)quinazolin-6-yl]prop-2-enamide

SMILES

O=C(/C=C/c1ccco1)Nc1cc2c(N3CCCCC3)ncnc2cc1

InChI

InChI=1S/C20H20N4O2/c25-19(9-7-16-5-4-12-26-16)23-15-6-8-18-17(13-15)20(22-14-21-18)24-10-2-1-3-11-24/h4-9,12-14H,1-3,10-11H2,(H,23,25)

InChI Key

SOGVMRCAXGTNMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27539881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.066

Distribution Coefficient, logD

4.064

Water Solubility, LogSw

-4.07

Polar Surface Area

53.775

Acid Dissociation Constant (pKa)

11.84

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

M381-2996 in Drug Discovery

Included in Screening Libraries

Hsp90-Targeted Library (11355 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with M381-2996 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M381-2996?
Check Price and Availability of M381-2996, 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 M381-2996 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M381-2996
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M381-2996
  • 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 M381-2996 available by request