M036-0163 Screening compound: N-[(2,4-difluorophenyl)methyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

M036-0163 Screening compound: N-[(2,4-difluorophenyl)methyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
M036-0163 Screening compound: N-[(2,4-difluorophenyl)methyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M036-0163
N-[(2,4-difluorophenyl)methyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

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

M036-0163

Molecular Formula

C19H13F2N3OS (C19 H13 F2 N3 OS)

Compound Name

N-[(2,4-difluorophenyl)methyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

N-[(24-difluorophenyl)methyl]-3-(1H-pyrrol-1-yl)thieno[23-b]pyridine-2-carboxamide

SMILES

O=C(c(sc1ncccc11)c1-n1cccc1)NCc(ccc(F)c1)c1F

InChI

InChI=1S/C19H13F2N3OS/c20-13-6-5-12(15(21)10-13)11-23-18(25)17-16(24-8-1-2-9-24)14-4-3-7-22-19(14)26-17/h1-10H,11H2,(H,23,25)

InChI Key

GNQCYIIDJNDQLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20736040

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.240

Distribution Coefficient, logD

4.238

Water Solubility, LogSw

-4.44

Polar Surface Area

38.188

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

4.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

M036-0163 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M036-0163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M036-0163?
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What is the minimum amount of M036-0163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M036-0163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M036-0163
  • 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 M036-0163 available by request