8014-0673 Screening compound: 2-{(Z)-1-[4-(benzyloxy)-3-chlorophenyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

8014-0673 Screening compound: 2-{(Z)-1-[4-(benzyloxy)-3-chlorophenyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one
8014-0673 Screening compound: 2-{(Z)-1-[4-(benzyloxy)-3-chlorophenyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-0673
2-{(Z)-1-[4-(benzyloxy)-3-chlorophenyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

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

8014-0673

Molecular Formula

C23H15ClN2O2S (C23 H15 ClN2 O2 S)

Compound Name

2-{(Z)-1-[4-(benzyloxy)-3-chlorophenyl]methylidene}[1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

IUPAC name

(4Z)-4-{[4-(benzyloxy)-3-chlorophenyl]methylidene}-5-thia-27-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)6911-tetraen-3-one

SMILES

O=C(/C(/S1)=C/c(cc2)cc(Cl)c2OCc2ccccc2)n2c1nc1c2cccc1

InChI

InChI=1S/C23H15ClN2O2S/c24-17-12-16(10-11-20(17)28-14-15-6-2-1-3-7-15)13-21-22(27)26-19-9-5-4-8-18(19)25-23(26)29-21/h1-13H,14H2

InChI Key

DEYRNIJIZAJXIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03217491

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.528

Distribution Coefficient, logD

5.528

Water Solubility, LogSw

-6.11

Polar Surface Area

31.767

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

-2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.35

References: we are preparing a list of scientific research reports with 8014-0673 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-0673?
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What is the minimum amount of 8014-0673 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-0673
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-0673
  • 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 8014-0673 available by request