D016-1208 Screening compound: 1-(5-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl)ethan-1-one

D016-1208 Screening compound: 1-(5-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl)ethan-1-one
D016-1208 Screening compound: 1-(5-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D016-1208
1-(5-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl)ethan-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

D016-1208

Molecular Formula

C32H36ClN3O3 (C32 H36 ClN3 O3)

Compound Name

1-(5-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl)ethan-1-one

IUPAC name

1-(5-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl)ethan-1-one

SMILES

CC(c(c1c2ccc(OCC(CN(CC3)CCN3c3c(C)ccc(Cl)c3)O)c1)c(C)n2-c1ccc(C)cc1)=O

InChI

InChI=1S/C32H36ClN3O3/c1-21-5-9-26(10-6-21)36-23(3)32(24(4)37)29-18-28(11-12-30(29)36)39-20-27(38)19-34-13-15-35(16-14-34)31-17-25(33)8-7-22(31)2/h5-12,17-18,27,38H,13-16,19-20H2,1-4H3/t27-/m0/s1

InChI Key

SRQZINXSEXWBIT-MHZLTWQESA-N

MDL Number (MFCD)

MFCD14810869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

546.11

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.439

Distribution Coefficient, logD

6.197

Water Solubility, LogSw

-6.13

Polar Surface Area

46.820

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

7.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.40

References: we are preparing a list of scientific research reports with D016-1208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D016-1208?
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What is the minimum amount of D016-1208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D016-1208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D016-1208
  • 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 D016-1208 available by request