K248-0268 Screening compound: N~1~-(5-chloro-2-methoxyphenyl)-2-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)-4-ethoxyanilino]acetamide

K248-0268 Screening compound: N~1~-(5-chloro-2-methoxyphenyl)-2-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)-4-ethoxyanilino]acetamide
K248-0268 Screening compound: N~1~-(5-chloro-2-methoxyphenyl)-2-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)-4-ethoxyanilino]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K248-0268
N~1~-(5-chloro-2-methoxyphenyl)-2-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)-4-ethoxyanilino]acetamide

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

K248-0268

Molecular Formula

C22H24ClN3O5S2 (C22 H24 ClN3 O5 S2)

Compound Name

N~1~-(5-chloro-2-methoxyphenyl)-2-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)-4-ethoxyanilino]acetamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-2-({55-dioxo-3aH4H6H6aH-5lambda6-thieno[34-d][13]thiazol-2-yl}(4-ethoxyphenyl)amino)acetamide

SMILES

CCOc(cc1)ccc1N(CC(Nc(cc(cc1)Cl)c1OC)=O)C1=NC(CS(C2)(=O)=O)C2S1

InChI

InChI=1S/C22H24ClN3O5S2/c1-3-31-16-7-5-15(6-8-16)26(22-25-18-12-33(28,29)13-20(18)32-22)11-21(27)24-17-10-14(23)4-9-19(17)30-2/h4-10,18,20H,3,11-13H2,1-2H3,(H,24,27)

InChI Key

JOZIDBBUTPYTAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06403379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.03

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.489

Distribution Coefficient, logD

3.482

Water Solubility, LogSw

-3.84

Polar Surface Area

77.221

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with K248-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K248-0268?
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What is the minimum amount of K248-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K248-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K248-0268
  • 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 K248-0268 available by request