D256-1231 Screening compound: ethyl 4-[1-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]piperazine-1-carboxylate

D256-1231 Screening compound: ethyl 4-[1-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]piperazine-1-carboxylate
D256-1231 Screening compound: ethyl 4-[1-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D256-1231
ethyl 4-[1-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]piperazine-1-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

D256-1231

Molecular Formula

C23H26ClN3O5S (C23 H26 ClN3 O5 S)

Compound Name

ethyl 4-[1-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]piperazine-1-carboxylate

IUPAC name

ethyl 4-[1-(4-chlorobenzenesulfonyl)-1234-tetrahydroquinoline-6-carbonyl]piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c(cc1)cc(CCC2)c1N2S(c(cc1)ccc1Cl)(=O)=O)=O)=O

InChI

InChI=1S/C23H26ClN3O5S/c1-2-32-23(29)26-14-12-25(13-15-26)22(28)18-5-10-21-17(16-18)4-3-11-27(21)33(30,31)20-8-6-19(24)7-9-20/h5-10,16H,2-4,11-15H2,1H3

InChI Key

XGEJDYBMWRAVLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09671634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.053

Distribution Coefficient, logD

3.053

Water Solubility, LogSw

-3.60

Polar Surface Area

70.819

Acid Dissociation Constant (pKa)

24.75

Base Dissociation Constant (pKb)

-1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

D256-1231 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D256-1231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D256-1231?
Check Price and Availability of D256-1231, 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 D256-1231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D256-1231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D256-1231
  • 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 D256-1231 available by request