K408-0006 Screening compound: methyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate

K408-0006 Screening compound: methyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate
K408-0006 Screening compound: methyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K408-0006
methyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-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

K408-0006

Molecular Formula

C22H29N3O5S2 (C22 H29 N3 O5 S2)

Compound Name

methyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate

IUPAC name

methyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-methyl-4H5H6H7H-thieno[23-c]pyridine-3-carboxylate

SMILES

CCCCN(C)S(c(cc1)ccc1C(Nc1c(C(OC)=O)c(CCN(C)C2)c2s1)=O)(=O)=O

InChI

InChI=1S/C22H29N3O5S2/c1-5-6-12-25(3)32(28,29)16-9-7-15(8-10-16)20(26)23-21-19(22(27)30-4)17-11-13-24(2)14-18(17)31-21/h7-10H,5-6,11-14H2,1-4H3,(H,23,26)

InChI Key

ANMSDIKNWAXKFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05017357

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

479.62

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.130

Distribution Coefficient, logD

-1.536

Water Solubility, LogSw

-3.64

Polar Surface Area

80.443

Acid Dissociation Constant (pKa)

3.24

Base Dissociation Constant (pKb)

6.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

K408-0006 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with K408-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K408-0006?
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What is the minimum amount of K408-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K408-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K408-0006
  • 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 K408-0006 available by request