2015-0023 Screening compound: [(1E)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]amino 2-iodobenzoate

2015-0023 Screening compound: [(1E)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]amino 2-iodobenzoate
2015-0023 Screening compound: [(1E)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]amino 2-iodobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2015-0023
[(1E)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]amino 2-iodobenzoate

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

2015-0023

Molecular Formula

C18H16INO3 (C18 H16 INO3)

Compound Name

[(1E)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]amino 2-iodobenzoate

IUPAC name

[(1E)-7-methoxy-1234-tetrahydronaphthalen-1-ylidene]amino 2-iodobenzoate

SMILES

COc1cc(/C(/CCC2)=N/OC(c(cccc3)c3I)=O)c2cc1

InChI

InChI=1S/C18H16INO3/c1-22-13-10-9-12-5-4-8-17(15(12)11-13)20-23-18(21)14-6-2-3-7-16(14)19/h2-3,6-7,9-11H,4-5,8H2,1H3

InChI Key

XRIBEEZBYIQSRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02084232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.410

Distribution Coefficient, logD

4.410

Water Solubility, LogSw

-4.51

Polar Surface Area

39.026

Acid Dissociation Constant (pKa)

22.22

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 2015-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2015-0023?
Check Price and Availability of 2015-0023, 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 2015-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2015-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2015-0023
  • 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 2015-0023 available by request