L011-0498 Screening compound: 3-[6-(cyclohexylamino)pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide

L011-0498 Screening compound: 3-[6-(cyclohexylamino)pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide
L011-0498 Screening compound: 3-[6-(cyclohexylamino)pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L011-0498
3-[6-(cyclohexylamino)pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide

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

L011-0498

Molecular Formula

C23H23FN4O (C23 H23 FN4 O)

Compound Name

3-[6-(cyclohexylamino)pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide

IUPAC name

3-[6-(cyclohexylamino)pyrimidin-4-yl]-N-(4-fluorophenyl)benzamide

SMILES

O=C(c1cc(-c2ncnc(NC3CCCCC3)c2)ccc1)Nc(cc1)ccc1F

InChI

InChI=1S/C23H23FN4O/c24-18-9-11-20(12-10-18)28-23(29)17-6-4-5-16(13-17)21-14-22(26-15-25-21)27-19-7-2-1-3-8-19/h4-6,9-15,19H,1-3,7-8H2,(H,28,29)(H,25,26,27)

InChI Key

HVTTYIXCJDGIQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27226372

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.358

Distribution Coefficient, logD

5.357

Water Solubility, LogSw

-5.70

Polar Surface Area

53.395

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

L011-0498 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with L011-0498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L011-0498?
Check Price and Availability of L011-0498, 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 L011-0498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L011-0498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L011-0498
  • 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 L011-0498 available by request