3002-1119 Screening compound: 3-[(5Z)-2-[(3,4-dimethylphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one

3002-1119 Screening compound: 3-[(5Z)-2-[(3,4-dimethylphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one
3002-1119 Screening compound: 3-[(5Z)-2-[(3,4-dimethylphenyl)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 3002-1119
3-[(5Z)-2-[(3,4-dimethylphenyl)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

3002-1119

Molecular Formula

C19H15N3O2S (C19 H15 N3 O2 S)

Compound Name

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

IUPAC name

3-[(5Z)-2-[(34-dimethylphenyl)amino]-4-oxo-45-dihydro-13-thiazol-5-ylidene]-23-dihydro-1H-indol-2-one

SMILES

Cc(cc1)c(C)cc1NC(S/C1=C(/c(cccc2)c2N2)\C2=O)=NC1=O

InChI

InChI=1S/C19H15N3O2S/c1-10-7-8-12(9-11(10)2)20-19-22-18(24)16(25-19)15-13-5-3-4-6-14(13)21-17(15)23/h3-9H,1-2H3,(H,21,23)(H,20,22,24)

InChI Key

WBZYYYFWNVIPII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01918429

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.828

Distribution Coefficient, logD

3.827

Water Solubility, LogSw

-3.97

Polar Surface Area

56.868

Acid Dissociation Constant (pKa)

9.92

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 3002-1119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3002-1119?
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What is the minimum amount of 3002-1119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3002-1119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3002-1119
  • 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 3002-1119 available by request