V011-0471 Screening compound: N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N-propylcyclopropanecarboxamide

V011-0471 Screening compound: N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N-propylcyclopropanecarboxamide
V011-0471 Screening compound: N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N-propylcyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-0471
N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N-propylcyclopropanecarboxamide

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

V011-0471

Molecular Formula

C24H25ClFN3O2 (C24 H25 ClFN3 O2)

Compound Name

N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N-propylcyclopropanecarboxamide

IUPAC name

N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-34-dihydroquinazolin-2-yl]propyl}-N-propylcyclopropanecarboxamide

SMILES

CCCN(C(CC)C(N1c(cc2)cc(Cl)c2F)=Nc(cccc2)c2C1=O)C(C1CC1)=O

InChI

InChI=1S/C24H25ClFN3O2/c1-3-13-28(23(30)15-9-10-15)21(4-2)22-27-20-8-6-5-7-17(20)24(31)29(22)16-11-12-19(26)18(25)14-16/h5-8,11-12,14-15,21H,3-4,9-10,13H2,1-2H3/t21-/m0/s1

InChI Key

RKJMJLZTXFSJAJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD01643545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.93

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.531

Distribution Coefficient, logD

4.493

Water Solubility, LogSw

-4.65

Polar Surface Area

40.671

Acid Dissociation Constant (pKa)

19.04

Base Dissociation Constant (pKb)

6.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

V011-0471 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PI3K-Targeted Library (17255 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V011-0471 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-0471?
Check Price and Availability of V011-0471, 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 V011-0471 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-0471
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-0471
  • 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 V011-0471 available by request