L531-0567 Screening compound: 4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3,5-dimethylphenyl)benzamide

L531-0567 Screening compound: 4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3,5-dimethylphenyl)benzamide
L531-0567 Screening compound: 4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3,5-dimethylphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L531-0567
4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3,5-dimethylphenyl)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

L531-0567

Molecular Formula

C26H25N3O (C26 H25 N3 O)

Compound Name

4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3,5-dimethylphenyl)benzamide

IUPAC name

4-[3-(25-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(35-dimethylphenyl)benzamide

SMILES

Cc1ccc(C)n1-c1cccnc1-c(cc1)ccc1C(Nc1cc(C)cc(C)c1)=O

InChI

InChI=1S/C26H25N3O/c1-17-14-18(2)16-23(15-17)28-26(30)22-11-9-21(10-12-22)25-24(6-5-13-27-25)29-19(3)7-8-20(29)4/h5-16H,1-4H3,(H,28,30)

InChI Key

SPVKIUYQMOQUCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15129976

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.917

Distribution Coefficient, logD

4.914

Water Solubility, LogSw

-4.56

Polar Surface Area

35.464

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

L531-0567 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 L531-0567 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L531-0567?
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What is the minimum amount of L531-0567 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L531-0567
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L531-0567
  • 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 L531-0567 available by request