8377-1489 Screening compound: 2-(4-bromophenoxy)-N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-methylpropanamide

8377-1489 Screening compound: 2-(4-bromophenoxy)-N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-methylpropanamide
8377-1489 Screening compound: 2-(4-bromophenoxy)-N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8377-1489
2-(4-bromophenoxy)-N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-methylpropanamide

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

8377-1489

Molecular Formula

C25H23BrN2O3 (C25 H23 BrN2 O3)

Compound Name

2-(4-bromophenoxy)-N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-2-methylpropanamide

IUPAC name

2-(4-bromophenoxy)-N-[3-(5-ethyl-13-benzoxazol-2-yl)phenyl]-2-methylpropanamide

SMILES

CCc(cc1)cc2c1oc(-c1cccc(NC(C(C)(C)Oc(cc3)ccc3Br)=O)c1)n2

InChI

InChI=1S/C25H23BrN2O3/c1-4-16-8-13-22-21(14-16)28-23(30-22)17-6-5-7-19(15-17)27-24(29)25(2,3)31-20-11-9-18(26)10-12-20/h5-15H,4H2,1-3H3,(H,27,29)

InChI Key

PABZIYAMUIPHNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07144622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.951

Distribution Coefficient, logD

6.951

Water Solubility, LogSw

-5.66

Polar Surface Area

46.359

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8377-1489 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

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

CNS targets activity set (6557 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 8377-1489 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8377-1489?
Check Price and Availability of 8377-1489, 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 8377-1489 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8377-1489
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8377-1489
  • 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 8377-1489 available by request