M062-0697 Screening compound: 5-benzyl-N-[(2-chlorophenyl)methyl]-4-oxo-4H,5H-thieno[3,2-c]pyridine-2-carboxamide

M062-0697 Screening compound: 5-benzyl-N-[(2-chlorophenyl)methyl]-4-oxo-4H,5H-thieno[3,2-c]pyridine-2-carboxamide
M062-0697 Screening compound: 5-benzyl-N-[(2-chlorophenyl)methyl]-4-oxo-4H,5H-thieno[3,2-c]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M062-0697
5-benzyl-N-[(2-chlorophenyl)methyl]-4-oxo-4H,5H-thieno[3,2-c]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

M062-0697

Molecular Formula

C22H17ClN2O2S (C22 H17 ClN2 O2 S)

Compound Name

5-benzyl-N-[(2-chlorophenyl)methyl]-4-oxo-4H,5H-thieno[3,2-c]pyridine-2-carboxamide

IUPAC name

5-benzyl-N-[(2-chlorophenyl)methyl]-4-oxo-4H5H-thieno[32-c]pyridine-2-carboxamide

SMILES

O=C(c1cc(C(N(Cc2ccccc2)C=C2)=O)c2s1)NCc(cccc1)c1Cl

InChI

InChI=1S/C22H17ClN2O2S/c23-18-9-5-4-8-16(18)13-24-21(26)20-12-17-19(28-20)10-11-25(22(17)27)14-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,24,26)

InChI Key

PKYASJOWEIQMQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495375

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.285

Distribution Coefficient, logD

4.285

Water Solubility, LogSw

-4.49

Polar Surface Area

41.113

Acid Dissociation Constant (pKa)

11.04

Base Dissociation Constant (pKb)

-5.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

M062-0697 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with M062-0697 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M062-0697?
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What is the minimum amount of M062-0697 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M062-0697
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M062-0697
  • 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 M062-0697 available by request