3343-0222 Screening compound: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(dimethylamino)benzamide

3343-0222 Screening compound: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(dimethylamino)benzamide
3343-0222 Screening compound: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(dimethylamino)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3343-0222
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(dimethylamino)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

3343-0222

Molecular Formula

C22H19N3O2 (C22 H19 N3 O2)

Compound Name

N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(dimethylamino)benzamide

IUPAC name

N-[4-(13-benzoxazol-2-yl)phenyl]-4-(dimethylamino)benzamide

SMILES

CN(C)c(cc1)ccc1C(Nc(cc1)ccc1-c1nc(cccc2)c2o1)=O

InChI

InChI=1S/C22H19N3O2/c1-25(2)18-13-9-15(10-14-18)21(26)23-17-11-7-16(8-12-17)22-24-19-5-3-4-6-20(19)27-22/h3-14H,1-2H3,(H,23,26)

InChI Key

MCRQRUUSZBUDOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04418617

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.651

Distribution Coefficient, logD

4.651

Water Solubility, LogSw

-4.48

Polar Surface Area

42.945

Acid Dissociation Constant (pKa)

11.44

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

3343-0222 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Nucleic Acid Ligands (8311 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with 3343-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3343-0222?
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What is the minimum amount of 3343-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3343-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3343-0222
  • 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 3343-0222 available by request