1473-0528 Screening compound: 2-{[(2-methoxyphenyl)amino]methyl}-octahydro-1H-isoindole-1,3-dione

1473-0528 Screening compound: 2-{[(2-methoxyphenyl)amino]methyl}-octahydro-1H-isoindole-1,3-dione
1473-0528 Screening compound: 2-{[(2-methoxyphenyl)amino]methyl}-octahydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1473-0528
2-{[(2-methoxyphenyl)amino]methyl}-octahydro-1H-isoindole-1,3-dione

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

1473-0528

Molecular Formula

C16H20N2O3 (C16 H20 N2 O3)

Compound Name

2-{[(2-methoxyphenyl)amino]methyl}-octahydro-1H-isoindole-1,3-dione

IUPAC name

2-{[(2-methoxyphenyl)amino]methyl}-octahydro-1H-isoindole-13-dione

SMILES

COc(cccc1)c1NCN(C(C1C2CCCC1)=O)C2=O

InChI

InChI=1S/C16H20N2O3/c1-21-14-9-5-4-8-13(14)17-10-18-15(19)11-6-2-3-7-12(11)16(18)20/h4-5,8-9,11-12,17H,2-3,6-7,10H2,1H3

InChI Key

AIIHSIAAYOTGKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00761484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.148

Distribution Coefficient, logD

2.148

Water Solubility, LogSw

-2.67

Polar Surface Area

47.776

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

2.63

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 1473-0528 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1473-0528?
Check Price and Availability of 1473-0528, 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 1473-0528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1473-0528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1473-0528
  • 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 1473-0528 available by request