C137-2650 Screening compound: 1-acetyl-5-bromo-N-(3-chloro-4-methylphenyl)-2-methyl-2,3-dihydro-1H-indole-6-sulfonamide

C137-2650 Screening compound: 1-acetyl-5-bromo-N-(3-chloro-4-methylphenyl)-2-methyl-2,3-dihydro-1H-indole-6-sulfonamide
C137-2650 Screening compound: 1-acetyl-5-bromo-N-(3-chloro-4-methylphenyl)-2-methyl-2,3-dihydro-1H-indole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C137-2650
1-acetyl-5-bromo-N-(3-chloro-4-methylphenyl)-2-methyl-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

C137-2650

Molecular Formula

C18H18BrClN2O3S (C18 H18 BrClN2 O3 S)

Compound Name

1-acetyl-5-bromo-N-(3-chloro-4-methylphenyl)-2-methyl-2,3-dihydro-1H-indole-6-sulfonamide

IUPAC name

1-acetyl-5-bromo-N-(3-chloro-4-methylphenyl)-2-methyl-23-dihydro-1H-indole-6-sulfonamide

SMILES

CC(Cc1c2)N(C(C)=O)c1cc(S(Nc1cc(Cl)c(C)cc1)(=O)=O)c2Br

InChI

InChI=1S/C18H18BrClN2O3S/c1-10-4-5-14(8-16(10)20)21-26(24,25)18-9-17-13(7-15(18)19)6-11(2)22(17)12(3)23/h4-5,7-9,11,21H,6H2,1-3H3/t11-/m1/s1

InChI Key

NESYWWMZULYROU-LLVKDONJSA-N

MDL Number (MFCD)

MFCD14721912

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.78

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.736

Distribution Coefficient, logD

3.903

Water Solubility, LogSw

-4.74

Polar Surface Area

56.245

Acid Dissociation Constant (pKa)

6.64

Base Dissociation Constant (pKb)

-2.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.78

References: we are preparing a list of scientific research reports with C137-2650 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C137-2650
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C137-2650
  • 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 C137-2650 available by request