M286-1986 Screening compound: methyl 2-({3-[(thiomorpholin-4-yl)methyl]-1H-indol-4-yl}formamido)acetate

M286-1986 Screening compound: methyl 2-({3-[(thiomorpholin-4-yl)methyl]-1H-indol-4-yl}formamido)acetate
M286-1986 Screening compound: methyl 2-({3-[(thiomorpholin-4-yl)methyl]-1H-indol-4-yl}formamido)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound M286-1986
methyl 2-({3-[(thiomorpholin-4-yl)methyl]-1H-indol-4-yl}formamido)acetate

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

M286-1986

Molecular Formula

C17H21N3O3S (C17 H21 N3 O3 S)

Compound Name

methyl 2-({3-[(thiomorpholin-4-yl)methyl]-1H-indol-4-yl}formamido)acetate

IUPAC name

methyl 2-({3-[(thiomorpholin-4-yl)methyl]-1H-indol-4-yl}formamido)acetate

SMILES

COC(CNC(c1c(c(CN2CCSCC2)c[nH]2)c2ccc1)=O)=O

InChI

InChI=1S/C17H21N3O3S/c1-23-15(21)10-19-17(22)13-3-2-4-14-16(13)12(9-18-14)11-20-5-7-24-8-6-20/h2-4,9,18H,5-8,10-11H2,1H3,(H,19,22)

InChI Key

QONWBIVBRXCONB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27535194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.779

Distribution Coefficient, logD

1.182

Water Solubility, LogSw

-2.69

Polar Surface Area

59.106

Acid Dissociation Constant (pKa)

14.16

Base Dissociation Constant (pKb)

7.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

M286-1986 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M286-1986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M286-1986?
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What is the minimum amount of M286-1986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M286-1986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M286-1986
  • 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 M286-1986 available by request