6196-0076 Screening compound: methyl 4-({N'-[(3E)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methoxy)benzoate

6196-0076 Screening compound: methyl 4-({N'-[(3E)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methoxy)benzoate
6196-0076 Screening compound: methyl 4-({N'-[(3E)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methoxy)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6196-0076
methyl 4-({N'-[(3E)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methoxy)benzoate

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

6196-0076

Molecular Formula

C18H15N3O5 (C18 H15 N3 O5)

Compound Name

methyl 4-({N'-[(3E)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methoxy)benzoate

IUPAC name

methyl 4-({N'-[(3E)-2-oxo-23-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methoxy)benzoate

SMILES

COC(c(cc1)ccc1OCC(N/N=C(\c(cccc1)c1N1)/C1=O)=O)=O

InChI

InChI=1S/C18H15N3O5/c1-25-18(24)11-6-8-12(9-7-11)26-10-15(22)20-21-16-13-4-2-3-5-14(13)19-17(16)23/h2-9H,10H2,1H3,(H,20,22)(H,19,21,23)

InChI Key

MWXXTLAQDSWNGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08236317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.33

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.392

Distribution Coefficient, logD

2.386

Water Solubility, LogSw

-3.00

Polar Surface Area

87.824

Acid Dissociation Constant (pKa)

9.29

Base Dissociation Constant (pKb)

-1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 6196-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6196-0076?
Check Price and Availability of 6196-0076, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6196-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6196-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6196-0076
  • 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 6196-0076 available by request