V017-0026 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[3-phenyl-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}benzamide

V017-0026 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[3-phenyl-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}benzamide
V017-0026 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[3-phenyl-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-0026
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[3-phenyl-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}benzamide

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

V017-0026

Molecular Formula

C29H27N3O4 (C29 H27 N3 O4)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[3-phenyl-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}benzamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-N-{[3-phenyl-5-(pyrrolidin-1-yl)-12-oxazol-4-yl]methyl}benzamide

SMILES

O=C(c1ccccc1)N(Cc1c(N2CCCC2)onc1-c1ccccc1)Cc(cc1)cc2c1OCO2

InChI

InChI=1S/C29H27N3O4/c33-28(23-11-5-2-6-12-23)32(18-21-13-14-25-26(17-21)35-20-34-25)19-24-27(22-9-3-1-4-10-22)30-36-29(24)31-15-7-8-16-31/h1-6,9-14,17H,7-8,15-16,18-20H2

InChI Key

JPNLTYGHKZUOOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10463349

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

481.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.903

Distribution Coefficient, logD

4.903

Water Solubility, LogSw

-4.91

Polar Surface Area

59.958

Acid Dissociation Constant (pKa)

22.54

Base Dissociation Constant (pKb)

-3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

References: we are preparing a list of scientific research reports with V017-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-0026?
Check Price and Availability of V017-0026, 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 V017-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-0026
  • 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 V017-0026 available by request