V019-4548 Screening compound: 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide

V019-4548 Screening compound: 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide
V019-4548 Screening compound: 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-4548
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-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

V019-4548

Molecular Formula

C29H29N3O5 (C29 H29 N3 O5)

Compound Name

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

IUPAC name

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

SMILES

CCOc1ccc(CN(Cc2nc(C(NCc3ccccc3)=O)co2)Cc(cc2)cc3c2OCO3)cc1

InChI

InChI=1S/C29H29N3O5/c1-2-34-24-11-8-22(9-12-24)16-32(17-23-10-13-26-27(14-23)37-20-36-26)18-28-31-25(19-35-28)29(33)30-15-21-6-4-3-5-7-21/h3-14,19H,2,15-18,20H2,1H3,(H,30,33)

InChI Key

ABCAUNRNFIZKJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19828223

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.543

Distribution Coefficient, logD

4.543

Water Solubility, LogSw

-4.26

Polar Surface Area

70.737

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.14

V019-4548 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with V019-4548 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-4548?
Check Price and Availability of V019-4548, 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 V019-4548 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-4548
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-4548
  • 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 V019-4548 available by request