2810-1161 Screening compound: 3,4,5-trimethoxy-N-[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]benzamide

2810-1161 Screening compound: 3,4,5-trimethoxy-N-[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]benzamide
2810-1161 Screening compound: 3,4,5-trimethoxy-N-[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2810-1161
3,4,5-trimethoxy-N-[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]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

2810-1161

Molecular Formula

C22H19N3O5 (C22 H19 N3 O5)

Compound Name

3,4,5-trimethoxy-N-[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]benzamide

IUPAC name

345-trimethoxy-N-[2-(pyridin-3-yl)-13-benzoxazol-5-yl]benzamide

SMILES

COc1cc(C(Nc(cc2)cc3c2oc(-c2cnccc2)n3)=O)cc(OC)c1OC

InChI

InChI=1S/C22H19N3O5/c1-27-18-9-14(10-19(28-2)20(18)29-3)21(26)24-15-6-7-17-16(11-15)25-22(30-17)13-5-4-8-23-12-13/h4-12H,1-3H3,(H,24,26)

InChI Key

FLLLPYYDKNEAMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01648504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.942

Distribution Coefficient, logD

2.940

Water Solubility, LogSw

-3.33

Polar Surface Area

72.636

Acid Dissociation Constant (pKa)

11.47

Base Dissociation Constant (pKb)

5.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

2810-1161 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2810-1161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2810-1161?
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What is the minimum amount of 2810-1161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2810-1161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2810-1161
  • 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 2810-1161 available by request