K248-0067 Screening compound: 4-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)amino]-N~1~-isopentylbenzamide

K248-0067 Screening compound: 4-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)amino]-N~1~-isopentylbenzamide
K248-0067 Screening compound: 4-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)amino]-N~1~-isopentylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K248-0067
4-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)amino]-N~1~-isopentylbenzamide

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

K248-0067

Molecular Formula

C17H23N3O3S2 (C17 H23 N3 O3 S2)

Compound Name

4-[(5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl)amino]-N~1~-isopentylbenzamide

IUPAC name

4-({55-dioxo-3aH4H6H6aH-5lambda6-thieno[34-d][13]thiazol-2-yl}amino)-N-(3-methylbutyl)benzamide

SMILES

CC(C)CCNC(c(cc1)ccc1NC1=NC(CS(C2)(=O)=O)C2S1)=O

InChI

InChI=1S/C17H23N3O3S2/c1-11(2)7-8-18-16(21)12-3-5-13(6-4-12)19-17-20-14-9-25(22,23)10-15(14)24-17/h3-6,11,14-15H,7-10H2,1-2H3,(H,18,21)(H,19,20)

InChI Key

IMTGMLPXQQSHBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15083800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.129

Distribution Coefficient, logD

2.129

Water Solubility, LogSw

-2.83

Polar Surface Area

71.868

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

3.75

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.90

References: we are preparing a list of scientific research reports with K248-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K248-0067?
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What is the minimum amount of K248-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K248-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K248-0067
  • 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 K248-0067 available by request