K841-0197 Screening compound: 4-(4-benzylpiperazin-1-yl)-2-(2-fluorophenyl)quinazoline

K841-0197 Screening compound: 4-(4-benzylpiperazin-1-yl)-2-(2-fluorophenyl)quinazoline
K841-0197 Screening compound: 4-(4-benzylpiperazin-1-yl)-2-(2-fluorophenyl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound K841-0197
4-(4-benzylpiperazin-1-yl)-2-(2-fluorophenyl)quinazoline

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

K841-0197

Molecular Formula

C25H23FN4 (C25 H23 FN4)

Compound Name

4-(4-benzylpiperazin-1-yl)-2-(2-fluorophenyl)quinazoline

IUPAC name

4-(4-benzylpiperazin-1-yl)-2-(2-fluorophenyl)quinazoline

SMILES

Fc(cccc1)c1-c1nc2ccccc2c(N2CCN(Cc3ccccc3)CC2)n1

InChI

InChI=1S/C25H23FN4/c26-22-12-6-4-10-20(22)24-27-23-13-7-5-11-21(23)25(28-24)30-16-14-29(15-17-30)18-19-8-2-1-3-9-19/h1-13H,14-18H2

InChI Key

QYHBYHLILDBRAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03670673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.080

Distribution Coefficient, logD

4.811

Water Solubility, LogSw

-5.38

Polar Surface Area

25.179

Acid Dissociation Constant (pKa)

22.11

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

K841-0197 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K841-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K841-0197?
Check Price and Availability of K841-0197, 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 K841-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K841-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K841-0197
  • 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 K841-0197 available by request