8010-1396 Screening compound: 3-methyl-4-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

8010-1396 Screening compound: 3-methyl-4-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
8010-1396 Screening compound: 3-methyl-4-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-1396
3-methyl-4-nitro-N-(4-phenyl-1,3-thiazol-2-yl)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

8010-1396

Molecular Formula

C17H13N3O3S (C17 H13 N3 O3 S)

Compound Name

3-methyl-4-nitro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

IUPAC name

3-methyl-4-nitro-N-(4-phenyl-13-thiazol-2-yl)benzamide

SMILES

Cc(cc(cc1)C(Nc2nc(-c3ccccc3)cs2)=O)c1[N+]([O-])=O

InChI

InChI=1S/C17H13N3O3S/c1-11-9-13(7-8-15(11)20(22)23)16(21)19-17-18-14(10-24-17)12-5-3-2-4-6-12/h2-10H,1H3,(H,18,19,21)

InChI Key

KEPANEPMAYJAKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01355294

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.951

Distribution Coefficient, logD

4.948

Water Solubility, LogSw

-4.71

Polar Surface Area

66.185

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

8010-1396 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8010-1396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-1396?
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What is the minimum amount of 8010-1396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-1396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-1396
  • 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 8010-1396 available by request