M769-0104 Screening compound: N-{2-[5-(1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-3,5-dimethoxy-N-methylbenzamide

M769-0104 Screening compound: N-{2-[5-(1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-3,5-dimethoxy-N-methylbenzamide
M769-0104 Screening compound: N-{2-[5-(1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-3,5-dimethoxy-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M769-0104
N-{2-[5-(1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-3,5-dimethoxy-N-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

M769-0104

Molecular Formula

C22H22N4O4 (C22 H22 N4 O4)

Compound Name

N-{2-[5-(1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-3,5-dimethoxy-N-methylbenzamide

IUPAC name

N-{2-[5-(1H-indol-2-yl)-124-oxadiazol-3-yl]ethyl}-35-dimethoxy-N-methylbenzamide

SMILES

CN(CCc1noc(-c2cc(cccc3)c3[nH]2)n1)C(c1cc(OC)cc(OC)c1)=O

InChI

InChI=1S/C22H22N4O4/c1-26(22(27)15-10-16(28-2)13-17(11-15)29-3)9-8-20-24-21(30-25-20)19-12-14-6-4-5-7-18(14)23-19/h4-7,10-13,23H,8-9H2,1-3H3

InChI Key

KHQADTAFDYHMCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27553340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.782

Distribution Coefficient, logD

3.782

Water Solubility, LogSw

-4.12

Polar Surface Area

73.472

Acid Dissociation Constant (pKa)

17.03

Base Dissociation Constant (pKb)

-1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

M769-0104 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M769-0104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M769-0104?
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What is the minimum amount of M769-0104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M769-0104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M769-0104
  • 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 M769-0104 available by request