1611-4686 Screening compound: 2-[(Z)-1-(2,4-dichlorophenyl)methylidene][1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

1611-4686 Screening compound: 2-[(Z)-1-(2,4-dichlorophenyl)methylidene][1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one
1611-4686 Screening compound: 2-[(Z)-1-(2,4-dichlorophenyl)methylidene][1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1611-4686
2-[(Z)-1-(2,4-dichlorophenyl)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

1611-4686

Molecular Formula

C16H8Cl2N2OS (C16 H8 Cl2 N2 OS)

Compound Name

2-[(Z)-1-(2,4-dichlorophenyl)methylidene][1,3]thiazolo[3,2-a][1,3]benzimidazol-3-one

IUPAC name

(4Z)-4-[(24-dichlorophenyl)methylidene]-5-thia-27-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)6911-tetraen-3-one

SMILES

O=C(/C(/S1)=C/c(ccc(Cl)c2)c2Cl)n2c1nc1c2cccc1

InChI

InChI=1S/C16H8Cl2N2OS/c17-10-6-5-9(11(18)8-10)7-14-15(21)20-13-4-2-1-3-12(13)19-16(20)22-14/h1-8H

InChI Key

VVFZQPPWRYCMBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00632746

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.017

Distribution Coefficient, logD

5.017

Water Solubility, LogSw

-5.26

Polar Surface Area

24.453

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 1611-4686 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1611-4686?
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What is the minimum amount of 1611-4686 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1611-4686
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1611-4686
  • 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 1611-4686 available by request