6193-0059 Screening compound: 5-bromo-3-[(5Z)-2-[(3-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one

6193-0059 Screening compound: 5-bromo-3-[(5Z)-2-[(3-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one
6193-0059 Screening compound: 5-bromo-3-[(5Z)-2-[(3-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6193-0059
5-bromo-3-[(5Z)-2-[(3-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-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

6193-0059

Molecular Formula

C17H10BrN3O3S (C17 H10 BrN3 O3 S)

Compound Name

5-bromo-3-[(5Z)-2-[(3-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one

IUPAC name

5-bromo-3-[(5Z)-2-[(3-hydroxyphenyl)amino]-4-oxo-45-dihydro-13-thiazol-5-ylidene]-23-dihydro-1H-indol-2-one

SMILES

Oc1cccc(NC(S/C2=C(/c(cc(cc3)Br)c3N3)\C3=O)=NC2=O)c1

InChI

InChI=1S/C17H10BrN3O3S/c18-8-4-5-12-11(6-8)13(15(23)20-12)14-16(24)21-17(25-14)19-9-2-1-3-10(22)7-9/h1-7,22H,(H,20,23)(H,19,21,24)

InChI Key

VALXGZCPXKEBPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01182092

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.25

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.159

Distribution Coefficient, logD

3.148

Water Solubility, LogSw

-3.39

Polar Surface Area

74.485

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

6193-0059 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6193-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 6193-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6193-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6193-0059
  • 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 6193-0059 available by request