M769-0271 Screening compound: 2,4-difluoro-N-{2-[5-(6-methoxy-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N-methylbenzamide

M769-0271 Screening compound: 2,4-difluoro-N-{2-[5-(6-methoxy-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N-methylbenzamide
M769-0271 Screening compound: 2,4-difluoro-N-{2-[5-(6-methoxy-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M769-0271
2,4-difluoro-N-{2-[5-(6-methoxy-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-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

M769-0271

Molecular Formula

C21H18F2N4O3 (C21 H18 F2 N4 O3)

Compound Name

2,4-difluoro-N-{2-[5-(6-methoxy-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N-methylbenzamide

IUPAC name

24-difluoro-N-{2-[5-(6-methoxy-1H-indol-2-yl)-124-oxadiazol-3-yl]ethyl}-N-methylbenzamide

SMILES

CN(CCc1noc(-c2cc(ccc(OC)c3)c3[nH]2)n1)C(c(ccc(F)c1)c1F)=O

InChI

InChI=1S/C21H18F2N4O3/c1-27(21(28)15-6-4-13(22)10-16(15)23)8-7-19-25-20(30-26-19)18-9-12-3-5-14(29-2)11-17(12)24-18/h3-6,9-11,24H,7-8H2,1-2H3

InChI Key

UHNGIIDTXNMXPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27553398

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.091

Distribution Coefficient, logD

4.091

Water Solubility, LogSw

-4.36

Polar Surface Area

65.928

Acid Dissociation Constant (pKa)

17.18

Base Dissociation Constant (pKb)

-2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

M769-0271 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M769-0271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M769-0271?
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What is the minimum amount of M769-0271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M769-0271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M769-0271
  • 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 M769-0271 available by request