P076-0533 Screening compound: N-(4-acetamidophenyl)-1-[(2-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide

P076-0533 Screening compound: N-(4-acetamidophenyl)-1-[(2-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide
P076-0533 Screening compound: N-(4-acetamidophenyl)-1-[(2-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P076-0533
N-(4-acetamidophenyl)-1-[(2-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide

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

P076-0533

Molecular Formula

C26H24N4O2 (C26 H24 N4 O2)

Compound Name

N-(4-acetamidophenyl)-1-[(2-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide

IUPAC name

N-(4-acetamidophenyl)-1-[(2-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide

SMILES

CC(Nc(cc1)ccc1NC(c1cc(-c2ccncc2)cn1Cc1c(C)cccc1)=O)=O

InChI

InChI=1S/C26H24N4O2/c1-18-5-3-4-6-21(18)16-30-17-22(20-11-13-27-14-12-20)15-25(30)26(32)29-24-9-7-23(8-10-24)28-19(2)31/h3-15,17H,16H2,1-2H3,(H,28,31)(H,29,32)

InChI Key

ZXKWDUDZSDSEQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27562902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.412

Distribution Coefficient, logD

4.407

Water Solubility, LogSw

-4.19

Polar Surface Area

57.231

Acid Dissociation Constant (pKa)

12.68

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

References: we are preparing a list of scientific research reports with P076-0533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P076-0533?
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What is the minimum amount of P076-0533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P076-0533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P076-0533
  • 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 P076-0533 available by request