L539-0326 Screening compound: 3-[4-(3-methoxyphenoxy)pyrimidin-2-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

L539-0326 Screening compound: 3-[4-(3-methoxyphenoxy)pyrimidin-2-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
L539-0326 Screening compound: 3-[4-(3-methoxyphenoxy)pyrimidin-2-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L539-0326
3-[4-(3-methoxyphenoxy)pyrimidin-2-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)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

L539-0326

Molecular Formula

C28H25N3O3 (C28 H25 N3 O3)

Compound Name

3-[4-(3-methoxyphenoxy)pyrimidin-2-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

IUPAC name

3-[4-(3-methoxyphenoxy)pyrimidin-2-yl]-N-(1234-tetrahydronaphthalen-1-yl)benzamide

SMILES

COc1cccc(Oc2ccnc(-c3cccc(C(NC(CCC4)c5c4cccc5)=O)c3)n2)c1

InChI

InChI=1S/C28H25N3O3/c1-33-22-11-6-12-23(18-22)34-26-15-16-29-27(31-26)20-9-4-10-21(17-20)28(32)30-25-14-5-8-19-7-2-3-13-24(19)25/h2-4,6-7,9-13,15-18,25H,5,8,14H2,1H3,(H,30,32)/t25-/m0/s1

InChI Key

RQUITDLGISLJBF-VWLOTQADSA-N

MDL Number (MFCD)

MFCD15130204

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.285

Distribution Coefficient, logD

5.285

Water Solubility, LogSw

-5.22

Polar Surface Area

57.419

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

1.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.90

L539-0326 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L539-0326 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L539-0326?
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What is the minimum amount of L539-0326 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L539-0326
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L539-0326
  • 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 L539-0326 available by request