D175-0166 Screening compound: 4-amino-N-(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide

D175-0166 Screening compound: 4-amino-N-(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide
D175-0166 Screening compound: 4-amino-N-(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D175-0166
4-amino-N-(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-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

D175-0166

Molecular Formula

C15H21N5O5 (C15 H21 N5 O5)

Compound Name

4-amino-N-(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide

IUPAC name

4-amino-N-(2-{[(245-trimethoxyphenyl)methyl]amino}ethyl)-125-oxadiazole-3-carboxamide

SMILES

COc(cc1OC)c(CNCCNC(c2nonc2N)=O)cc1OC

InChI

InChI=1S/C15H21N5O5/c1-22-10-7-12(24-3)11(23-2)6-9(10)8-17-4-5-18-15(21)13-14(16)20-25-19-13/h6-7,17H,4-5,8H2,1-3H3,(H2,16,20)(H,18,21)

InChI Key

ROWJQFRZOYSFNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06612643

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

351.36

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.089

Distribution Coefficient, logD

-2.119

Water Solubility, LogSw

-1.33

Polar Surface Area

116.348

Acid Dissociation Constant (pKa)

14.03

Base Dissociation Constant (pKb)

9.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

D175-0166 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with D175-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D175-0166?
Check Price and Availability of D175-0166, 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 D175-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D175-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D175-0166
  • 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 D175-0166 available by request