G373-4029 Screening compound: N-(2,5-dimethoxyphenyl)-4-[(5-phenyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide

G373-4029 Screening compound: N-(2,5-dimethoxyphenyl)-4-[(5-phenyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide
G373-4029 Screening compound: N-(2,5-dimethoxyphenyl)-4-[(5-phenyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G373-4029
N-(2,5-dimethoxyphenyl)-4-[(5-phenyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-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

G373-4029

Molecular Formula

C27H28N4O4 (C27 H28 N4 O4)

Compound Name

N-(2,5-dimethoxyphenyl)-4-[(5-phenyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide

IUPAC name

N-(25-dimethoxyphenyl)-4-[(5-phenyl-13-benzoxazol-2-yl)methyl]piperazine-1-carboxamide

SMILES

COc(cc1)cc(NC(N2CCN(Cc3nc(cc(cc4)-c5ccccc5)c4o3)CC2)=O)c1OC

InChI

InChI=1S/C27H28N4O4/c1-33-21-9-11-24(34-2)23(17-21)29-27(32)31-14-12-30(13-15-31)18-26-28-22-16-20(8-10-25(22)35-26)19-6-4-3-5-7-19/h3-11,16-17H,12-15,18H2,1-2H3,(H,29,32)

InChI Key

HWZBRXVWYYGNGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27138176

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.54

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

4.608

Distribution Coefficient, logD

4.599

Water Solubility, LogSw

-4.45

Polar Surface Area

60.200

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

G373-4029 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

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

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G373-4029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G373-4029?
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What is the minimum amount of G373-4029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G373-4029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G373-4029
  • 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 G373-4029 available by request