0699-0236 Screening compound: 1-{[(3E)-1,4-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-3,3-dimethylthiourea

0699-0236 Screening compound: 1-{[(3E)-1,4-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-3,3-dimethylthiourea
0699-0236 Screening compound: 1-{[(3E)-1,4-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-3,3-dimethylthiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 0699-0236
1-{[(3E)-1,4-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-3,3-dimethylthiourea

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

0699-0236

Molecular Formula

C13H16N4OS (C13 H16 N4 OS)

Compound Name

1-{[(3E)-1,4-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-3,3-dimethylthiourea

IUPAC name

1-{[(3E)-14-dimethyl-2-oxo-23-dihydro-1H-indol-3-ylidene]amino}-33-dimethylthiourea

SMILES

Cc(cccc1N(C)C2=O)c1/C2=N\NC(N(C)C)=S

InChI

InChI=1S/C13H16N4OS/c1-8-6-5-7-9-10(8)11(12(18)17(9)4)14-15-13(19)16(2)3/h5-7H,1-4H3,(H,15,19)

InChI Key

JWBRMFSVFNARJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00991136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.797

Distribution Coefficient, logD

1.797

Water Solubility, LogSw

-2.39

Polar Surface Area

36.786

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

References: we are preparing a list of scientific research reports with 0699-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0699-0236?
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What is the minimum amount of 0699-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0699-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0699-0236
  • 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 0699-0236 available by request