8008-7826 Screening compound: ethyl N-[1,1,1,3,3,3-hexafluoro-2-({4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}amino)propan-2-yl]carbamate

8008-7826 Screening compound: ethyl N-[1,1,1,3,3,3-hexafluoro-2-({4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}amino)propan-2-yl]carbamate
8008-7826 Screening compound: ethyl N-[1,1,1,3,3,3-hexafluoro-2-({4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}amino)propan-2-yl]carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-7826
ethyl N-[1,1,1,3,3,3-hexafluoro-2-({4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}amino)propan-2-yl]carbamate

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

8008-7826

Molecular Formula

C15H14F6N4O4S2 (C15 H14 F6 N4 O4 S2)

Compound Name

ethyl N-[1,1,1,3,3,3-hexafluoro-2-({4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}amino)propan-2-yl]carbamate

IUPAC name

ethyl N-[111333-hexafluoro-2-({4-[(13-thiazol-2-yl)sulfamoyl]phenyl}amino)propan-2-yl]carbamate

SMILES

CCOC(NC(C(F)(F)F)(C(F)(F)F)Nc(cc1)ccc1S(Nc1nccs1)(=O)=O)=O

InChI

InChI=1S/C15H14F6N4O4S2/c1-2-29-12(26)24-13(14(16,17)18,15(19,20)21)23-9-3-5-10(6-4-9)31(27,28)25-11-22-7-8-30-11/h3-8,23H,2H2,1H3,(H,22,25)(H,24,26)

InChI Key

GESWPJZIMCWOKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00566221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.505

Distribution Coefficient, logD

-0.868

Water Solubility, LogSw

-3.81

Polar Surface Area

93.007

Acid Dissociation Constant (pKa)

3.03

Base Dissociation Constant (pKb)

0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8008-7826 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8008-7826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-7826?
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What is the minimum amount of 8008-7826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-7826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-7826
  • 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 8008-7826 available by request