C137-2232 Screening compound: 5-bromo-1-cyclopropanecarbonyl-N-[4-(propan-2-yl)phenyl]-2,3-dihydro-1H-indole-6-sulfonamide

C137-2232 Screening compound: 5-bromo-1-cyclopropanecarbonyl-N-[4-(propan-2-yl)phenyl]-2,3-dihydro-1H-indole-6-sulfonamide
C137-2232 Screening compound: 5-bromo-1-cyclopropanecarbonyl-N-[4-(propan-2-yl)phenyl]-2,3-dihydro-1H-indole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C137-2232
5-bromo-1-cyclopropanecarbonyl-N-[4-(propan-2-yl)phenyl]-2,3-dihydro-1H-indole-6-sulfonamide

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

C137-2232

Molecular Formula

C21H23BrN2O3S (C21 H23 BrN2 O3 S)

Compound Name

5-bromo-1-cyclopropanecarbonyl-N-[4-(propan-2-yl)phenyl]-2,3-dihydro-1H-indole-6-sulfonamide

IUPAC name

5-bromo-1-cyclopropanecarbonyl-N-[4-(propan-2-yl)phenyl]-23-dihydro-1H-indole-6-sulfonamide

SMILES

CC(C)c(cc1)ccc1NS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O

InChI

InChI=1S/C21H23BrN2O3S/c1-13(2)14-5-7-17(8-6-14)23-28(26,27)20-12-19-16(11-18(20)22)9-10-24(19)21(25)15-3-4-15/h5-8,11-13,15,23H,3-4,9-10H2,1-2H3

InChI Key

AICXZEITBQQYII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.175

Distribution Coefficient, logD

5.143

Water Solubility, LogSw

-5.03

Polar Surface Area

57.090

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

C137-2232 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C137-2232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C137-2232?
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What is the minimum amount of C137-2232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C137-2232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C137-2232
  • 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 C137-2232 available by request