L262-0546 Screening compound: N-(2-bromophenyl)-4-[6-(4-fluorophenyl)pyrimidin-4-yl]piperazine-1-carboxamide

L262-0546 Screening compound: N-(2-bromophenyl)-4-[6-(4-fluorophenyl)pyrimidin-4-yl]piperazine-1-carboxamide
L262-0546 Screening compound: N-(2-bromophenyl)-4-[6-(4-fluorophenyl)pyrimidin-4-yl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L262-0546
N-(2-bromophenyl)-4-[6-(4-fluorophenyl)pyrimidin-4-yl]piperazine-1-carboxamide

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

L262-0546

Molecular Formula

C21H19BrFN5O (C21 H19 BrFN5 O)

Compound Name

N-(2-bromophenyl)-4-[6-(4-fluorophenyl)pyrimidin-4-yl]piperazine-1-carboxamide

IUPAC name

N-(2-bromophenyl)-4-[6-(4-fluorophenyl)pyrimidin-4-yl]piperazine-1-carboxamide

SMILES

O=C(Nc(cccc1)c1Br)N(CC1)CCN1c1ncnc(-c(cc2)ccc2F)c1

InChI

InChI=1S/C21H19BrFN5O/c22-17-3-1-2-4-18(17)26-21(29)28-11-9-27(10-12-28)20-13-19(24-14-25-20)15-5-7-16(23)8-6-15/h1-8,13-14H,9-12H2,(H,26,29)

InChI Key

UOMSZVFVBJCEEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27238684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.053

Distribution Coefficient, logD

5.052

Water Solubility, LogSw

-4.98

Polar Surface Area

47.272

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

L262-0546 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L262-0546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L262-0546?
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What is the minimum amount of L262-0546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L262-0546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L262-0546
  • 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 L262-0546 available by request