L534-0691 Screening compound: N-butyl-3-(6-phenoxypyrimidin-4-yl)benzamide

L534-0691 Screening compound: N-butyl-3-(6-phenoxypyrimidin-4-yl)benzamide
L534-0691 Screening compound: N-butyl-3-(6-phenoxypyrimidin-4-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L534-0691
N-butyl-3-(6-phenoxypyrimidin-4-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

L534-0691

Molecular Formula

C21H21N3O2 (C21 H21 N3 O2)

Compound Name

N-butyl-3-(6-phenoxypyrimidin-4-yl)benzamide

IUPAC name

N-butyl-3-(6-phenoxypyrimidin-4-yl)benzamide

SMILES

CCCCNC(c1cc(-c2ncnc(Oc3ccccc3)c2)ccc1)=O

InChI

InChI=1S/C21H21N3O2/c1-2-3-12-22-21(25)17-9-7-8-16(13-17)19-14-20(24-15-23-19)26-18-10-5-4-6-11-18/h4-11,13-15H,2-3,12H2,1H3,(H,22,25)

InChI Key

CCOSAMBOCQOOGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27460302

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.145

Distribution Coefficient, logD

4.145

Water Solubility, LogSw

-4.22

Polar Surface Area

50.951

Acid Dissociation Constant (pKa)

13.95

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

L534-0691 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with L534-0691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L534-0691?
Check Price and Availability of L534-0691, 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 L534-0691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L534-0691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L534-0691
  • 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 L534-0691 available by request