2332-0437 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,4-dinitrobenzohydrazide

2332-0437 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,4-dinitrobenzohydrazide
2332-0437 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,4-dinitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2332-0437
N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,4-dinitrobenzohydrazide

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

2332-0437

Molecular Formula

C15H11N5O5S (C15 H11 N5 O5 S)

Compound Name

N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,4-dinitrobenzohydrazide

IUPAC name

N'-[(2E)-3-methyl-23-dihydro-13-benzothiazol-2-ylidene]-24-dinitrobenzohydrazide

SMILES

CN(c(cccc1)c1S1)/C1=N\NC(c(ccc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C15H11N5O5S/c1-18-11-4-2-3-5-13(11)26-15(18)17-16-14(21)10-7-6-9(19(22)23)8-12(10)20(24)25/h2-8H,1H3,(H,16,21)

InChI Key

ZDBMYTDIOWYZCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01537943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.35

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.829

Distribution Coefficient, logD

1.980

Water Solubility, LogSw

-3.72

Polar Surface Area

104.726

Acid Dissociation Constant (pKa)

6.62

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

References: we are preparing a list of scientific research reports with 2332-0437 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2332-0437?
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What is the minimum amount of 2332-0437 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2332-0437
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2332-0437
  • 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 2332-0437 available by request