8377-1414 Screening compound: N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)-2-methylpropanamide

8377-1414 Screening compound: N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)-2-methylpropanamide
8377-1414 Screening compound: N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8377-1414
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)-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

8377-1414

Molecular Formula

C24H21BrN2O4 (C24 H21 BrN2 O4)

Compound Name

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

IUPAC name

N-[5-(13-benzoxazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)-2-methylpropanamide

SMILES

CC(C)(C(Nc(cc(cc1)-c2nc(cccc3)c3o2)c1OC)=O)Oc(cc1)ccc1Br

InChI

InChI=1S/C24H21BrN2O4/c1-24(2,31-17-11-9-16(25)10-12-17)23(28)27-19-14-15(8-13-20(19)29-3)22-26-18-6-4-5-7-21(18)30-22/h4-14H,1-3H3,(H,27,28)

InChI Key

ABQMKUYPXNSQCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07144536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.083

Distribution Coefficient, logD

6.083

Water Solubility, LogSw

-5.59

Polar Surface Area

53.292

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8377-1414 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8377-1414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8377-1414?
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What is the minimum amount of 8377-1414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8377-1414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8377-1414
  • 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 8377-1414 available by request