2810-4086 Screening compound: N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide

2810-4086 Screening compound: N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide
2810-4086 Screening compound: N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2810-4086
N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide

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

2810-4086

Molecular Formula

C26H19BrN2O4 (C26 H19 BrN2 O4)

Compound Name

N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide

IUPAC name

N-[2-(5-bromonaphthalen-1-yl)-13-benzoxazol-5-yl]-35-dimethoxybenzamide

SMILES

COc1cc(C(Nc(cc2)cc3c2oc(-c2c(cccc4Br)c4ccc2)n3)=O)cc(OC)c1

InChI

InChI=1S/C26H19BrN2O4/c1-31-17-11-15(12-18(14-17)32-2)25(30)28-16-9-10-24-23(13-16)29-26(33-24)21-7-3-6-20-19(21)5-4-8-22(20)27/h3-14H,1-2H3,(H,28,30)

InChI Key

OUDKAPQOSBGGBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02084929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.478

Distribution Coefficient, logD

6.478

Water Solubility, LogSw

-6.03

Polar Surface Area

54.956

Acid Dissociation Constant (pKa)

11.17

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

2810-4086 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Regenerative Medicine Focused Library (23016 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:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 2810-4086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2810-4086?
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What is the minimum amount of 2810-4086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2810-4086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2810-4086
  • 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 2810-4086 available by request