G684-0366 Screening compound: N-(2-bromo-4-methylphenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide

G684-0366 Screening compound: N-(2-bromo-4-methylphenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
G684-0366 Screening compound: N-(2-bromo-4-methylphenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G684-0366
N-(2-bromo-4-methylphenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-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

G684-0366

Molecular Formula

C24H24BrN5O3 (C24 H24 BrN5 O3)

Compound Name

N-(2-bromo-4-methylphenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide

IUPAC name

N-(2-bromo-4-methylphenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-13-oxazol-4-yl]methyl}-5-methyl-1H-123-triazole-4-carboxamide

SMILES

CCOc(cc1)ccc1-c1nc(Cn2nnc(C(Nc(ccc(C)c3)c3Br)=O)c2C)c(C)o1

InChI

InChI=1S/C24H24BrN5O3/c1-5-32-18-9-7-17(8-10-18)24-27-21(16(4)33-24)13-30-15(3)22(28-29-30)23(31)26-20-11-6-14(2)12-19(20)25/h6-12H,5,13H2,1-4H3,(H,26,31)

InChI Key

WFXYNRMHYXMBIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27151239

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.691

Distribution Coefficient, logD

4.690

Water Solubility, LogSw

-4.28

Polar Surface Area

74.584

Acid Dissociation Constant (pKa)

9.98

Base Dissociation Constant (pKb)

2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G684-0366 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G684-0366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G684-0366?
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What is the minimum amount of G684-0366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G684-0366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G684-0366
  • 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 G684-0366 available by request