D169-0141 Screening compound: 3-ethyl-1-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)urea

D169-0141 Screening compound: 3-ethyl-1-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)urea
D169-0141 Screening compound: 3-ethyl-1-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D169-0141
3-ethyl-1-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)urea

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

D169-0141

Molecular Formula

C16H20N4O2 (C16 H20 N4 O2)

Compound Name

3-ethyl-1-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)urea

IUPAC name

3-ethyl-1-{[3-(3-methylphenyl)-124-oxadiazol-5-yl]methyl}-1-(prop-2-en-1-yl)urea

SMILES

CCNC(N(CC=C)Cc1nc(-c2cc(C)ccc2)no1)=O

InChI

InChI=1S/C16H20N4O2/c1-4-9-20(16(21)17-5-2)11-14-18-15(19-22-14)13-8-6-7-12(3)10-13/h4,6-8,10H,1,5,9,11H2,2-3H3,(H,17,21)

InChI Key

DDKUHUWTYVNXDS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09871340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.240

Distribution Coefficient, logD

3.240

Water Solubility, LogSw

-3.29

Polar Surface Area

57.811

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

References: we are preparing a list of scientific research reports with D169-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D169-0141?
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What is the minimum amount of D169-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D169-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D169-0141
  • 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 D169-0141 available by request