D347-4268 Screening compound: 2-[2-(1-butyl-5-oxopyrrolidin-3-yl)-1H-1,3-benzodiazol-1-yl]-N-ethyl-N-phenylacetamide

D347-4268 Screening compound: 2-[2-(1-butyl-5-oxopyrrolidin-3-yl)-1H-1,3-benzodiazol-1-yl]-N-ethyl-N-phenylacetamide
D347-4268 Screening compound: 2-[2-(1-butyl-5-oxopyrrolidin-3-yl)-1H-1,3-benzodiazol-1-yl]-N-ethyl-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-4268
2-[2-(1-butyl-5-oxopyrrolidin-3-yl)-1H-1,3-benzodiazol-1-yl]-N-ethyl-N-phenylacetamide

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

D347-4268

Molecular Formula

C25H30N4O2 (C25 H30 N4 O2)

Compound Name

2-[2-(1-butyl-5-oxopyrrolidin-3-yl)-1H-1,3-benzodiazol-1-yl]-N-ethyl-N-phenylacetamide

IUPAC name

2-[2-(1-butyl-5-oxopyrrolidin-3-yl)-1H-13-benzodiazol-1-yl]-N-ethyl-N-phenylacetamide

SMILES

CCCCN(CC(C1)c2nc(cccc3)c3n2CC(N(CC)c2ccccc2)=O)C1=O

InChI

InChI=1S/C25H30N4O2/c1-3-5-15-27-17-19(16-23(27)30)25-26-21-13-9-10-14-22(21)29(25)18-24(31)28(4-2)20-11-7-6-8-12-20/h6-14,19H,3-5,15-18H2,1-2H3/t19-/m1/s1

InChI Key

RVFQJWXDHKCVAZ-LJQANCHMSA-N

MDL Number (MFCD)

MFCD09148269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.828

Distribution Coefficient, logD

3.827

Water Solubility, LogSw

-3.69

Polar Surface Area

42.433

Acid Dissociation Constant (pKa)

13.85

Base Dissociation Constant (pKb)

4.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

D347-4268 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Kinases
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D347-4268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-4268?
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What is the minimum amount of D347-4268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-4268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-4268
  • 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 D347-4268 available by request