1699-1607 Screening compound: 2-[(E)-[(4-methoxynaphthalen-1-yl)methylidene]amino]-2,3-dihydro-1H-isoindole-1,3-dione

1699-1607 Screening compound: 2-[(E)-[(4-methoxynaphthalen-1-yl)methylidene]amino]-2,3-dihydro-1H-isoindole-1,3-dione
1699-1607 Screening compound: 2-[(E)-[(4-methoxynaphthalen-1-yl)methylidene]amino]-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1699-1607
2-[(E)-[(4-methoxynaphthalen-1-yl)methylidene]amino]-2,3-dihydro-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

1699-1607

Molecular Formula

C20H14N2O3 (C20 H14 N2 O3)

Compound Name

2-[(E)-[(4-methoxynaphthalen-1-yl)methylidene]amino]-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-[(E)-[(4-methoxynaphthalen-1-yl)methylidene]amino]-23-dihydro-1H-isoindole-13-dione

SMILES

COc1ccc(/C=N/N(C(c2c3cccc2)=O)C3=O)c2ccccc12

InChI

InChI=1S/C20H14N2O3/c1-25-18-11-10-13(14-6-2-3-7-15(14)18)12-21-22-19(23)16-8-4-5-9-17(16)20(22)24/h2-12H,1H3

InChI Key

HDTLFCFZZXGDTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00589401

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.944

Distribution Coefficient, logD

3.944

Water Solubility, LogSw

-4.10

Polar Surface Area

47.266

Acid Dissociation Constant (pKa)

32.58

Base Dissociation Constant (pKb)

-4.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

1699-1607 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1699-1607 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1699-1607?
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What is the minimum amount of 1699-1607 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1699-1607
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1699-1607
  • 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 1699-1607 available by request