C700-2547 Screening compound: N-[(1-benzoyl-2,3-dihydro-1H-indol-6-yl)methyl]-4-methoxybenzene-1-sulfonamide

C700-2547 Screening compound: N-[(1-benzoyl-2,3-dihydro-1H-indol-6-yl)methyl]-4-methoxybenzene-1-sulfonamide
C700-2547 Screening compound: N-[(1-benzoyl-2,3-dihydro-1H-indol-6-yl)methyl]-4-methoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2547
N-[(1-benzoyl-2,3-dihydro-1H-indol-6-yl)methyl]-4-methoxybenzene-1-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

C700-2547

Molecular Formula

C23H22N2O4S (C23 H22 N2 O4 S)

Compound Name

N-[(1-benzoyl-2,3-dihydro-1H-indol-6-yl)methyl]-4-methoxybenzene-1-sulfonamide

IUPAC name

N-[(1-benzoyl-23-dihydro-1H-indol-6-yl)methyl]-4-methoxybenzene-1-sulfonamide

SMILES

COc(cc1)ccc1S(NCc1cc(N(CC2)C(c3ccccc3)=O)c2cc1)(=O)=O

InChI

InChI=1S/C23H22N2O4S/c1-29-20-9-11-21(12-10-20)30(27,28)24-16-17-7-8-18-13-14-25(22(18)15-17)23(26)19-5-3-2-4-6-19/h2-12,15,24H,13-14,16H2,1H3

InChI Key

IESFLLLTPGAPMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26965765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.774

Distribution Coefficient, logD

3.774

Water Solubility, LogSw

-4.02

Polar Surface Area

65.219

Acid Dissociation Constant (pKa)

10.78

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

C700-2547 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C700-2547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2547?
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What is the minimum amount of C700-2547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2547
  • 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 C700-2547 available by request