C345-0180 Screening compound: 2-[5-(2H-1,3-benzodioxol-5-yl)-2-oxo-3-phenyl-2,3-dihydro-1H-imidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide

C345-0180 Screening compound: 2-[5-(2H-1,3-benzodioxol-5-yl)-2-oxo-3-phenyl-2,3-dihydro-1H-imidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide
C345-0180 Screening compound: 2-[5-(2H-1,3-benzodioxol-5-yl)-2-oxo-3-phenyl-2,3-dihydro-1H-imidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C345-0180
2-[5-(2H-1,3-benzodioxol-5-yl)-2-oxo-3-phenyl-2,3-dihydro-1H-imidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide

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

C345-0180

Molecular Formula

C26H23N3O4 (C26 H23 N3 O4)

Compound Name

2-[5-(2H-1,3-benzodioxol-5-yl)-2-oxo-3-phenyl-2,3-dihydro-1H-imidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide

IUPAC name

2-[5-(2H-13-benzodioxol-5-yl)-2-oxo-3-phenyl-23-dihydro-1H-imidazol-1-yl]-N-(26-dimethylphenyl)acetamide

SMILES

Cc1cccc(C)c1NC(CN(C(c(cc1)cc2c1OCO2)=CN1c2ccccc2)C1=O)=O

InChI

InChI=1S/C26H23N3O4/c1-17-7-6-8-18(2)25(17)27-24(30)15-29-21(19-11-12-22-23(13-19)33-16-32-22)14-28(26(29)31)20-9-4-3-5-10-20/h3-14H,15-16H2,1-2H3,(H,27,30)

InChI Key

FGIMQCIQKKCLBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14749961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.307

Distribution Coefficient, logD

4.307

Water Solubility, LogSw

-4.39

Polar Surface Area

57.354

Acid Dissociation Constant (pKa)

12.62

Base Dissociation Constant (pKb)

3.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

C345-0180 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C345-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C345-0180?
Check Price and Availability of C345-0180, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C345-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C345-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C345-0180
  • 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 C345-0180 available by request