D169-0394 Screening compound: 1-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)-3-propylurea

D169-0394 Screening compound: 1-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)-3-propylurea
D169-0394 Screening compound: 1-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound D169-0394
1-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)-3-propylurea

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

D169-0394

Molecular Formula

C17H22N4O3 (C17 H22 N4 O3)

Compound Name

1-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)-3-propylurea

IUPAC name

1-{[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)-3-propylurea

SMILES

CCCNC(N(CC=C)Cc1nc(-c(cc2)ccc2OC)no1)=O

InChI

InChI=1S/C17H22N4O3/c1-4-10-18-17(22)21(11-5-2)12-15-19-16(20-24-15)13-6-8-14(23-3)9-7-13/h5-9H,2,4,10-12H2,1,3H3,(H,18,22)

InChI Key

NZCBKMBBAUROIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07629074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.563

Distribution Coefficient, logD

3.563

Water Solubility, LogSw

-3.48

Polar Surface Area

65.571

Acid Dissociation Constant (pKa)

17.00

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

D169-0394 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D169-0394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D169-0394?
Check Price and Availability of D169-0394, 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 D169-0394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D169-0394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D169-0394
  • 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 D169-0394 available by request