V028-1764 Screening compound: 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-N-benzyl-N-methyl-1,3-oxazole-4-carboxamide

V028-1764 Screening compound: 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-N-benzyl-N-methyl-1,3-oxazole-4-carboxamide
V028-1764 Screening compound: 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-N-benzyl-N-methyl-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1764
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-N-benzyl-N-methyl-1,3-oxazole-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

V028-1764

Molecular Formula

C32H35N3O4 (C32 H35 N3 O4)

Compound Name

2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-N-benzyl-N-methyl-1,3-oxazole-4-carboxamide

IUPAC name

2-({[(2H-13-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-N-benzyl-N-methyl-13-oxazole-4-carboxamide

SMILES

CC(C)(C)c1ccc(CN(Cc2nc(C(N(C)Cc3ccccc3)=O)co2)Cc(cc2)cc3c2OCO3)cc1

InChI

InChI=1S/C32H35N3O4/c1-32(2,3)26-13-10-24(11-14-26)18-35(19-25-12-15-28-29(16-25)39-22-38-28)20-30-33-27(21-37-30)31(36)34(4)17-23-8-6-5-7-9-23/h5-16,21H,17-20,22H2,1-4H3

InChI Key

GKSNWFBLJOPQLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19827882

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

525.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.223

Distribution Coefficient, logD

6.221

Water Solubility, LogSw

-5.55

Polar Surface Area

55.350

Acid Dissociation Constant (pKa)

26.34

Base Dissociation Constant (pKb)

4.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

V028-1764 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V028-1764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1764?
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What is the minimum amount of V028-1764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1764
  • 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 V028-1764 available by request