6501-0183 Screening compound: (3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromo-1H-indol-3-yl}methylidene)-2,3-dihydro-1H-indol-2-one

6501-0183 Screening compound: (3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromo-1H-indol-3-yl}methylidene)-2,3-dihydro-1H-indol-2-one
6501-0183 Screening compound: (3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromo-1H-indol-3-yl}methylidene)-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6501-0183
(3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromo-1H-indol-3-yl}methylidene)-2,3-dihydro-1H-indol-2-one

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

6501-0183

Molecular Formula

C25H24BrN3O2 (C25 H24 BrN3 O2)

Compound Name

(3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromo-1H-indol-3-yl}methylidene)-2,3-dihydro-1H-indol-2-one

IUPAC name

(3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromo-1H-indol-3-yl}methylidene)-23-dihydro-1H-indol-2-one

SMILES

O=C(Cn1c(ccc(Br)c2)c2c(/C=C(\c(cccc2)c2N2)/C2=O)c1)N1CCCCCC1

InChI

InChI=1S/C25H24BrN3O2/c26-18-9-10-23-20(14-18)17(13-21-19-7-3-4-8-22(19)27-25(21)31)15-29(23)16-24(30)28-11-5-1-2-6-12-28/h3-4,7-10,13-15H,1-2,5-6,11-12,16H2,(H,27,31)

InChI Key

NASBZLQTDQHZNX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04335626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.639

Distribution Coefficient, logD

4.639

Water Solubility, LogSw

-4.35

Polar Surface Area

43.666

Acid Dissociation Constant (pKa)

15.31

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with 6501-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6501-0183?
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What is the minimum amount of 6501-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6501-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6501-0183
  • 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 6501-0183 available by request