L531-0494 Screening compound: 4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3-methoxyphenyl)benzamide

L531-0494 Screening compound: 4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3-methoxyphenyl)benzamide
L531-0494 Screening compound: 4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3-methoxyphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L531-0494
4-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]-N-(3-methoxyphenyl)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

L531-0494

Molecular Formula

C25H23N3O2 (C25 H23 N3 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(C)n1-c1cccnc1-c(cc1)ccc1C(Nc1cc(OC)ccc1)=O

InChI

InChI=1S/C25H23N3O2/c1-17-9-10-18(2)28(17)23-8-5-15-26-24(23)19-11-13-20(14-12-19)25(29)27-21-6-4-7-22(16-21)30-3/h4-16H,1-3H3,(H,27,29)

InChI Key

IQDDQMWIEPXVLT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15129956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.290

Distribution Coefficient, logD

4.287

Water Solubility, LogSw

-4.35

Polar Surface Area

43.008

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

L531-0494 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L531-0494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L531-0494?
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What is the minimum amount of L531-0494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L531-0494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L531-0494
  • 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 L531-0494 available by request