2372-2977 Screening compound: 4-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide

2372-2977 Screening compound: 4-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide
2372-2977 Screening compound: 4-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2372-2977
4-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide

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

2372-2977

Molecular Formula

C27H16N4O7S (C27 H16 N4 O7 S)

Compound Name

4-(5-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide

IUPAC name

4-(5-nitro-13-dioxo-23-dihydro-1H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide

SMILES

[O-][N+](c(cc1)ccc1Sc(cc1)ccc1NC(c(cc1)ccc1N(C(c(cc1)c2cc1[N+]([O-])=O)=O)C2=O)=O)=O

InChI

InChI=1S/C27H16N4O7S/c32-25(28-17-3-10-21(11-4-17)39-22-12-7-19(8-13-22)30(35)36)16-1-5-18(6-2-16)29-26(33)23-14-9-20(31(37)38)15-24(23)27(29)34/h1-15H,(H,28,32)

InChI Key

GJFKAJIVGVHZRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00307957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

540.51

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.694

Distribution Coefficient, logD

5.694

Water Solubility, LogSw

-5.92

Polar Surface Area

118.463

Acid Dissociation Constant (pKa)

10.85

Base Dissociation Constant (pKb)

-1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2372-2977 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2372-2977 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2372-2977?
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What is the minimum amount of 2372-2977 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2372-2977
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2372-2977
  • 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 2372-2977 available by request