D109-0191 Screening compound: N-[4-(3,4-dipropoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-methylbenzamide

D109-0191 Screening compound: N-[4-(3,4-dipropoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-methylbenzamide
D109-0191 Screening compound: N-[4-(3,4-dipropoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D109-0191
N-[4-(3,4-dipropoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-methylbenzamide

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

D109-0191

Molecular Formula

C22H25N3O4 (C22 H25 N3 O4)

Compound Name

N-[4-(3,4-dipropoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-methylbenzamide

IUPAC name

N-[4-(34-dipropoxyphenyl)-125-oxadiazol-3-yl]-2-methylbenzamide

SMILES

CCCOc(ccc(-c1nonc1NC(c1c(C)cccc1)=O)c1)c1OCCC

InChI

InChI=1S/C22H25N3O4/c1-4-12-27-18-11-10-16(14-19(18)28-13-5-2)20-21(25-29-24-20)23-22(26)17-9-7-6-8-15(17)3/h6-11,14H,4-5,12-13H2,1-3H3,(H,23,25,26)

InChI Key

QLUXZRQABNVLRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06648323

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.360

Distribution Coefficient, logD

5.208

Water Solubility, LogSw

-5.31

Polar Surface Area

75.095

Acid Dissociation Constant (pKa)

7.78

Base Dissociation Constant (pKb)

-5.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

D109-0191 in Drug Discovery

Included in Screening Libraries

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D109-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D109-0191?
Check Price and Availability of D109-0191, 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 D109-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D109-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D109-0191
  • 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 D109-0191 available by request