G434-1246 Screening compound: 1-(3-bromophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)urea

G434-1246 Screening compound: 1-(3-bromophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)urea
G434-1246 Screening compound: 1-(3-bromophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G434-1246
1-(3-bromophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)urea

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

G434-1246

Molecular Formula

C14H10BrN3O3 (C14 H10 BrN3 O3)

Compound Name

1-(3-bromophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)urea

IUPAC name

1-(3-bromophenyl)-3-(2-oxo-23-dihydro-13-benzoxazol-6-yl)urea

SMILES

O=C(Nc(cc1)cc(O2)c1NC2=O)Nc1cccc(Br)c1

InChI

InChI=1S/C14H10BrN3O3/c15-8-2-1-3-9(6-8)16-13(19)17-10-4-5-11-12(7-10)21-14(20)18-11/h1-7H,(H,18,20)(H2,16,17,19)

InChI Key

BVNFNAVQLFRNFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27142033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.16

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.743

Distribution Coefficient, logD

3.743

Water Solubility, LogSw

-4.16

Polar Surface Area

65.959

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

G434-1246 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G434-1246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G434-1246?
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What is the minimum amount of G434-1246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G434-1246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G434-1246
  • 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 G434-1246 available by request