C361-1892 Screening compound: 3-[(1-ACETYL-2,3-DIHYDRO-1H-INDOL-5-YL)SULFONYL]-1-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]-1-PROPANONE

C361-1892 Screening compound: 3-[(1-ACETYL-2,3-DIHYDRO-1H-INDOL-5-YL)SULFONYL]-1-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]-1-PROPANONE
C361-1892 Screening compound: 3-[(1-ACETYL-2,3-DIHYDRO-1H-INDOL-5-YL)SULFONYL]-1-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound C361-1892
3-[(1-ACETYL-2,3-DIHYDRO-1H-INDOL-5-YL)SULFONYL]-1-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]-1-PROPANONE

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

C361-1892

Molecular Formula

C25H29N3O6S (C25 H29 N3 O6 S)

Compound Name

3-[(1-ACETYL-2,3-DIHYDRO-1H-INDOL-5-YL)SULFONYL]-1-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]-1-PROPANONE

IUPAC name

n/a

SMILES

CC(N(CC1)c(cc2)c1cc2S(CCC(N1CCN(Cc(cc2)cc3c2OCO3)CC1)=O)(=O)=O)=O

InChI

InChI=1S/C25H29N3O6S/c1-18(29)28-8-6-20-15-21(3-4-22(20)28)35(31,32)13-7-25(30)27-11-9-26(10-12-27)16-19-2-5-23-24(14-19)34-17-33-23/h2-5,14-15H,6-13,16-17H2,1H3

InChI Key

MQGXIYYLNBGJDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14753039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.020

Distribution Coefficient, logD

0.675

Water Solubility, LogSw

-2.45

Polar Surface Area

82.470

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with C361-1892 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C361-1892?
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What is the minimum amount of C361-1892 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C361-1892
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C361-1892
  • 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 C361-1892 available by request