1606-0410 Screening compound: N-(4-acetylphenyl)-2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

1606-0410 Screening compound: N-(4-acetylphenyl)-2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
1606-0410 Screening compound: N-(4-acetylphenyl)-2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1606-0410
N-(4-acetylphenyl)-2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

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

1606-0410

Molecular Formula

C27H18N2O4 (C27 H18 N2 O4)

Compound Name

N-(4-acetylphenyl)-2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

IUPAC name

N-(4-acetylphenyl)-2-(naphthalen-1-yl)-13-dioxo-23-dihydro-1H-isoindole-5-carboxamide

SMILES

CC(c(cc1)ccc1NC(c(cc1)cc(C(N2c3cccc4ccccc34)=O)c1C2=O)=O)=O

InChI

InChI=1S/C27H18N2O4/c1-16(30)17-9-12-20(13-10-17)28-25(31)19-11-14-22-23(15-19)27(33)29(26(22)32)24-8-4-6-18-5-2-3-7-21(18)24/h2-15H,1H3,(H,28,31)

InChI Key

LEFVZMLZMITZLR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01028016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.612

Distribution Coefficient, logD

4.526

Water Solubility, LogSw

-4.79

Polar Surface Area

65.225

Acid Dissociation Constant (pKa)

8.06

Base Dissociation Constant (pKb)

-5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.70

1606-0410 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1606-0410 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1606-0410?
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What is the minimum amount of 1606-0410 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1606-0410
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1606-0410
  • 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 1606-0410 available by request