D328-0101 Screening compound: N~1~-[(5-bromo-2-furyl)methyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-2-phenylacetamide

D328-0101 Screening compound: N~1~-[(5-bromo-2-furyl)methyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-2-phenylacetamide
D328-0101 Screening compound: N~1~-[(5-bromo-2-furyl)methyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D328-0101
N~1~-[(5-bromo-2-furyl)methyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-2-phenylacetamide

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

D328-0101

Molecular Formula

C17H18BrNO4S (C17 H18 BrNO4 S)

Compound Name

N~1~-[(5-bromo-2-furyl)methyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-2-phenylacetamide

IUPAC name

N-[(5-bromofuran-2-yl)methyl]-N-(11-dioxo-1lambda6-thiolan-3-yl)-2-phenylacetamide

SMILES

O=C(Cc1ccccc1)N(Cc(o1)ccc1Br)C(CC1)CS1(=O)=O

InChI

InChI=1S/C17H18BrNO4S/c18-16-7-6-15(23-16)11-19(14-8-9-24(21,22)12-14)17(20)10-13-4-2-1-3-5-13/h1-7,14H,8-12H2/t14-/m0/s1

InChI Key

PMJQZKNNGMECQS-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD08550187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.238

Distribution Coefficient, logD

2.238

Water Solubility, LogSw

-2.44

Polar Surface Area

51.429

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

-5.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.30

D328-0101 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D328-0101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D328-0101?
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What is the minimum amount of D328-0101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D328-0101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D328-0101
  • 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 D328-0101 available by request