C137-0125 Screening compound: 3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-6-yl)sulfonyl]-N-(3-ethylphenyl)propanamide

C137-0125 Screening compound: 3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-6-yl)sulfonyl]-N-(3-ethylphenyl)propanamide
C137-0125 Screening compound: 3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-6-yl)sulfonyl]-N-(3-ethylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C137-0125
3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-6-yl)sulfonyl]-N-(3-ethylphenyl)propanamide

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

C137-0125

Molecular Formula

C21H23BrN2O4S (C21 H23 BrN2 O4 S)

Compound Name

3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-6-yl)sulfonyl]-N-(3-ethylphenyl)propanamide

IUPAC name

3-[(1-acetyl-5-bromo-23-dihydro-1H-indol-6-yl)sulfonyl]-N-(3-ethylphenyl)propanamide

SMILES

CCc1cccc(NC(CCS(c(cc(c(CC2)c3)N2C(C)=O)c3Br)(=O)=O)=O)c1

InChI

InChI=1S/C21H23BrN2O4S/c1-3-15-5-4-6-17(11-15)23-21(26)8-10-29(27,28)20-13-19-16(12-18(20)22)7-9-24(19)14(2)25/h4-6,11-13H,3,7-10H2,1-2H3,(H,23,26)

InChI Key

AMPBUPNKCNXGEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721364

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.385

Distribution Coefficient, logD

3.385

Water Solubility, LogSw

-3.78

Polar Surface Area

68.571

Acid Dissociation Constant (pKa)

11.97

Base Dissociation Constant (pKb)

-0.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with C137-0125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C137-0125?
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What is the minimum amount of C137-0125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C137-0125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C137-0125
  • 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 C137-0125 available by request