D357-0415 Screening compound: N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide

D357-0415 Screening compound: N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide
D357-0415 Screening compound: N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D357-0415
N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide

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

D357-0415

Molecular Formula

C21H17BrN2O3 (C21 H17 BrN2 O3)

Compound Name

N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide

IUPAC name

N-[3-(4-bromophenyl)-12-oxazol-5-yl]-346-trimethyl-1-benzofuran-2-carboxamide

SMILES

Cc1c(C(Nc2cc(-c(cc3)ccc3Br)no2)=O)oc2c1c(C)cc(C)c2

InChI

InChI=1S/C21H17BrN2O3/c1-11-8-12(2)19-13(3)20(26-17(19)9-11)21(25)23-18-10-16(24-27-18)14-4-6-15(22)7-5-14/h4-10H,1-3H3,(H,23,25)

InChI Key

JBHXTQSJPCCGIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12920013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.532

Distribution Coefficient, logD

6.530

Water Solubility, LogSw

-5.91

Polar Surface Area

54.136

Acid Dissociation Constant (pKa)

9.75

Base Dissociation Constant (pKb)

-5.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

D357-0415 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D357-0415 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D357-0415?
Check Price and Availability of D357-0415, 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 D357-0415 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D357-0415
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D357-0415
  • 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 D357-0415 available by request