2595-1263 Screening compound: N-(2,5-dimethylphenyl)-3-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

2595-1263 Screening compound: N-(2,5-dimethylphenyl)-3-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanamide
2595-1263 Screening compound: N-(2,5-dimethylphenyl)-3-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2595-1263
N-(2,5-dimethylphenyl)-3-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

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

2595-1263

Molecular Formula

C19H17N3O5 (C19 H17 N3 O5)

Compound Name

N-(2,5-dimethylphenyl)-3-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

IUPAC name

N-(25-dimethylphenyl)-3-(4-nitro-13-dioxo-23-dihydro-1H-isoindol-2-yl)propanamide

SMILES

Cc1cc(NC(CCN(C(c2cccc([N+]([O-])=O)c22)=O)C2=O)=O)c(C)cc1

InChI

InChI=1S/C19H17N3O5/c1-11-6-7-12(2)14(10-11)20-16(23)8-9-21-18(24)13-4-3-5-15(22(26)27)17(13)19(21)25/h3-7,10H,8-9H2,1-2H3,(H,20,23)

InChI Key

DYZLQXWROYSUMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02165997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.36

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.392

Distribution Coefficient, logD

1.392

Water Solubility, LogSw

-2.47

Polar Surface Area

85.002

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

2595-1263 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 2595-1263 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2595-1263?
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What is the minimum amount of 2595-1263 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2595-1263
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2595-1263
  • 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 2595-1263 available by request