8602-0008 Screening compound: N-(4-{[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]sulfamoyl}phenyl)acetamide

8602-0008 Screening compound: N-(4-{[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]sulfamoyl}phenyl)acetamide
8602-0008 Screening compound: N-(4-{[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]sulfamoyl}phenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8602-0008
N-(4-{[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]sulfamoyl}phenyl)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

8602-0008

Molecular Formula

C26H26F3N3O5S (C26 H26 F3 N3 O5 S)

Compound Name

N-(4-{[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]sulfamoyl}phenyl)acetamide

IUPAC name

N-(4-{[1-benzyl-66-dimethyl-24-dioxo-3-(trifluoromethyl)-234567-hexahydro-1H-indol-3-yl]sulfamoyl}phenyl)acetamide

SMILES

CC(C)(CC(N(Cc1ccccc1)C1=O)=C2C1(C(F)(F)F)NS(c(cc1)ccc1NC(C)=O)(=O)=O)CC2=O

InChI

InChI=1S/C26H26F3N3O5S/c1-16(33)30-18-9-11-19(12-10-18)38(36,37)31-25(26(27,28)29)22-20(13-24(2,3)14-21(22)34)32(23(25)35)15-17-7-5-4-6-8-17/h4-12,31H,13-15H2,1-3H3,(H,30,33)/t25-/m0/s1

InChI Key

AXSSGMLLUYBFPL-VWLOTQADSA-N

MDL Number (MFCD)

MFCD08098166

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

549.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.433

Distribution Coefficient, logD

0.129

Water Solubility, LogSw

-3.87

Polar Surface Area

95.143

Acid Dissociation Constant (pKa)

4.10

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with 8602-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 8602-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8602-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8602-0008
  • 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 8602-0008 available by request