D256-0392 Screening compound: ethyl 1-[1-(4-methylbenzenesulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]piperidine-4-carboxylate

D256-0392 Screening compound: ethyl 1-[1-(4-methylbenzenesulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]piperidine-4-carboxylate
D256-0392 Screening compound: ethyl 1-[1-(4-methylbenzenesulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D256-0392
ethyl 1-[1-(4-methylbenzenesulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]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

D256-0392

Molecular Formula

C24H28N2O5S (C24 H28 N2 O5 S)

Compound Name

ethyl 1-[1-(4-methylbenzenesulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[1-(4-methylbenzenesulfonyl)-23-dihydro-1H-indole-5-carbonyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c(cc1)cc(CC2)c1N2S(c1ccc(C)cc1)(=O)=O)=O)=O

InChI

InChI=1S/C24H28N2O5S/c1-3-31-24(28)18-10-13-25(14-11-18)23(27)20-6-9-22-19(16-20)12-15-26(22)32(29,30)21-7-4-17(2)5-8-21/h4-9,16,18H,3,10-15H2,1-2H3

InChI Key

AOAIOWDDLHZRBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09670220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.294

Distribution Coefficient, logD

3.294

Water Solubility, LogSw

-3.50

Polar Surface Area

69.159

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

D256-0392 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with D256-0392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D256-0392?
Check Price and Availability of D256-0392, 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 D256-0392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D256-0392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D256-0392
  • 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 D256-0392 available by request