L370-0536 Screening compound: 4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-[(2-methylphenyl)methyl]benzamide

L370-0536 Screening compound: 4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-[(2-methylphenyl)methyl]benzamide
L370-0536 Screening compound: 4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-[(2-methylphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L370-0536
4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-[(2-methylphenyl)methyl]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

L370-0536

Molecular Formula

C25H21FN4O (C25 H21 FN4 O)

Compound Name

4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-[(2-methylphenyl)methyl]benzamide

IUPAC name

4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-[(2-methylphenyl)methyl]benzamide

SMILES

Cc1c(CNC(c(cc2)ccc2Nc(nc2)ncc2-c2cccc(F)c2)=O)cccc1

InChI

InChI=1S/C25H21FN4O/c1-17-5-2-3-6-20(17)14-27-24(31)18-9-11-23(12-10-18)30-25-28-15-21(16-29-25)19-7-4-8-22(26)13-19/h2-13,15-16H,14H2,1H3,(H,27,31)(H,28,29,30)

InChI Key

OOUDXIWPIJEDNV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15125459

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.362

Distribution Coefficient, logD

5.361

Water Solubility, LogSw

-5.28

Polar Surface Area

54.041

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

L370-0536 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with L370-0536 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L370-0536?
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What is the minimum amount of L370-0536 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L370-0536
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L370-0536
  • 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 L370-0536 available by request