D016-0544 Screening compound: ethyl 1-(3-{[3-acetyl-2-methyl-1-(4-methylphenyl)-1H-indol-5-yl]oxy}-2-hydroxypropyl)piperidine-4-carboxylate

D016-0544 Screening compound: ethyl 1-(3-{[3-acetyl-2-methyl-1-(4-methylphenyl)-1H-indol-5-yl]oxy}-2-hydroxypropyl)piperidine-4-carboxylate
D016-0544 Screening compound: ethyl 1-(3-{[3-acetyl-2-methyl-1-(4-methylphenyl)-1H-indol-5-yl]oxy}-2-hydroxypropyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D016-0544
ethyl 1-(3-{[3-acetyl-2-methyl-1-(4-methylphenyl)-1H-indol-5-yl]oxy}-2-hydroxypropyl)piperidine-4-carboxylate

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

D016-0544

Molecular Formula

C29H36N2O5 (C29 H36 N2 O5)

Compound Name

ethyl 1-(3-{[3-acetyl-2-methyl-1-(4-methylphenyl)-1H-indol-5-yl]oxy}-2-hydroxypropyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(3-{[3-acetyl-2-methyl-1-(4-methylphenyl)-1H-indol-5-yl]oxy}-2-hydroxypropyl)piperidine-4-carboxylate

SMILES

CCOC(C1CCN(CC(COc(cc2)cc(c(C(C)=O)c3C)c2n3-c2ccc(C)cc2)O)CC1)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.506

Distribution Coefficient, logD

3.122

Water Solubility, LogSw

-4.32

Polar Surface Area

64.614

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

8.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.80

D016-0544 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D016-0544 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D016-0544?
Check Price and Availability of D016-0544, 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 D016-0544 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D016-0544
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D016-0544
  • 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 D016-0544 available by request