E746-0689 Screening compound: 3-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one

E746-0689 Screening compound: 3-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one
E746-0689 Screening compound: 3-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E746-0689
3-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-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

E746-0689

Molecular Formula

C26H33N3O4S (C26 H33 N3 O4 S)

Compound Name

3-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one

IUPAC name

3-[(1-acetyl-23-dihydro-1H-indol-5-yl)sulfonyl]-1-[4-(23-dimethylphenyl)piperazin-1-yl]butan-1-one

SMILES

CC(CC(N(CC1)CCN1c1c(C)c(C)ccc1)=O)S(c(cc1)cc(CC2)c1N2C(C)=O)(=O)=O

InChI

InChI=1S/C26H33N3O4S/c1-18-6-5-7-24(20(18)3)27-12-14-28(15-13-27)26(31)16-19(2)34(32,33)23-8-9-25-22(17-23)10-11-29(25)21(4)30/h5-9,17,19H,10-16H2,1-4H3/t19-/m0/s1

InChI Key

JHQCAUXWJITLBS-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14914923

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.123

Distribution Coefficient, logD

3.123

Water Solubility, LogSw

-3.47

Polar Surface Area

65.509

Acid Dissociation Constant (pKa)

18.79

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

References: we are preparing a list of scientific research reports with E746-0689 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E746-0689?
Check Price and Availability of E746-0689, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E746-0689 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E746-0689
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E746-0689
  • 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 E746-0689 available by request