M036-0196 Screening compound: tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-amido]piperidine-1-carboxylate

M036-0196 Screening compound: tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-amido]piperidine-1-carboxylate
M036-0196 Screening compound: tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-amido]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound M036-0196
tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-amido]piperidine-1-carboxylate

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

M036-0196

Molecular Formula

C22H26N4O3S (C22 H26 N4 O3 S)

Compound Name

tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-amido]piperidine-1-carboxylate

IUPAC name

tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[23-b]pyridine-2-amido]piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1NC(c(sc1ncccc11)c1-n1cccc1)=O)=O

InChI

InChI=1S/C22H26N4O3S/c1-22(2,3)29-21(28)26-13-8-15(9-14-26)24-19(27)18-17(25-11-4-5-12-25)16-7-6-10-23-20(16)30-18/h4-7,10-12,15H,8-9,13-14H2,1-3H3,(H,24,27)

InChI Key

VJTPURLMHYAAOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15139260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.54

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

4.335

Distribution Coefficient, logD

4.333

Water Solubility, LogSw

-4.22

Polar Surface Area

59.803

Acid Dissociation Constant (pKa)

16.36

Base Dissociation Constant (pKb)

4.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with M036-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M036-0196?
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What is the minimum amount of M036-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M036-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M036-0196
  • 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 M036-0196 available by request