J029-1852 Screening compound: N-{3-[1-(4-bromophenyl)cyclopentaneamido]-4-methylphenyl}furan-2-carboxamide

J029-1852 Screening compound: N-{3-[1-(4-bromophenyl)cyclopentaneamido]-4-methylphenyl}furan-2-carboxamide
J029-1852 Screening compound: N-{3-[1-(4-bromophenyl)cyclopentaneamido]-4-methylphenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J029-1852
N-{3-[1-(4-bromophenyl)cyclopentaneamido]-4-methylphenyl}furan-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

J029-1852

Molecular Formula

C24H23BrN2O3 (C24 H23 BrN2 O3)

Compound Name

N-{3-[1-(4-bromophenyl)cyclopentaneamido]-4-methylphenyl}furan-2-carboxamide

IUPAC name

N-{3-[1-(4-bromophenyl)cyclopentaneamido]-4-methylphenyl}furan-2-carboxamide

SMILES

Cc(ccc(NC(c1ccco1)=O)c1)c1NC(C1(CCCC1)c(cc1)ccc1Br)=O

InChI

InChI=1S/C24H23BrN2O3/c1-16-6-11-19(26-22(28)21-5-4-14-30-21)15-20(16)27-23(29)24(12-2-3-13-24)17-7-9-18(25)10-8-17/h4-11,14-15H,2-3,12-13H2,1H3,(H,26,28)(H,27,29)

InChI Key

VYUXFIZPLKOZFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11694255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.441

Distribution Coefficient, logD

5.441

Water Solubility, LogSw

-5.30

Polar Surface Area

54.588

Acid Dissociation Constant (pKa)

10.91

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

J029-1852 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with J029-1852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J029-1852?
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What is the minimum amount of J029-1852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J029-1852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J029-1852
  • 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 J029-1852 available by request