D101-0375 Screening compound: N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,4,5-trimethoxybenzamide

D101-0375 Screening compound: N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,4,5-trimethoxybenzamide
D101-0375 Screening compound: N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0375
N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,4,5-trimethoxybenzamide

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

D101-0375

Molecular Formula

C19H18ClN3O5 (C19 H18 ClN3 O5)

Compound Name

N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,4,5-trimethoxybenzamide

IUPAC name

N-{[3-(4-chlorophenyl)-124-oxadiazol-5-yl]methyl}-345-trimethoxybenzamide

SMILES

COc1cc(C(NCc2nc(-c(cc3)ccc3Cl)no2)=O)cc(OC)c1OC

InChI

InChI=1S/C19H18ClN3O5/c1-25-14-8-12(9-15(26-2)17(14)27-3)19(24)21-10-16-22-18(23-28-16)11-4-6-13(20)7-5-11/h4-9H,10H2,1-3H3,(H,21,24)

InChI Key

GDPQUMPAGVPQJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06791192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.82

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.758

Distribution Coefficient, logD

3.758

Water Solubility, LogSw

-4.45

Polar Surface Area

78.973

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

-6.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D101-0375 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D101-0375 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0375?
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What is the minimum amount of D101-0375 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0375
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0375
  • 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 D101-0375 available by request