C156-0098 Screening compound: N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)-2,2-dimethylpropanamide

C156-0098 Screening compound: N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)-2,2-dimethylpropanamide
C156-0098 Screening compound: N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C156-0098
N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)-2,2-dimethylpropanamide

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

C156-0098

Molecular Formula

C22H26N2O2S (C22 H26 N2 O2 S)

Compound Name

N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)-2,2-dimethylpropanamide

IUPAC name

N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)-22-dimethylpropanamide

SMILES

CC(C)(C)C(NCCSc1c(-c(cc2)ccc2OC)[nH]c2c1cccc2)=O

InChI

InChI=1S/C22H26N2O2S/c1-22(2,3)21(25)23-13-14-27-20-17-7-5-6-8-18(17)24-19(20)15-9-11-16(26-4)12-10-15/h5-12,24H,13-14H2,1-4H3,(H,23,25)

InChI Key

GYPVGBFLSFJQMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03829171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.208

Distribution Coefficient, logD

4.208

Water Solubility, LogSw

-4.25

Polar Surface Area

42.157

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with C156-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C156-0098?
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What is the minimum amount of C156-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C156-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C156-0098
  • 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 C156-0098 available by request