3824-0020 Screening compound: 1-(5,7-dichloro-2,3,4,4a-tetrahydro-1H-xanthen-4a-yl)piperidine

3824-0020 Screening compound: 1-(5,7-dichloro-2,3,4,4a-tetrahydro-1H-xanthen-4a-yl)piperidine
3824-0020 Screening compound: 1-(5,7-dichloro-2,3,4,4a-tetrahydro-1H-xanthen-4a-yl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3824-0020
1-(5,7-dichloro-2,3,4,4a-tetrahydro-1H-xanthen-4a-yl)piperidine

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

3824-0020

Molecular Formula

C18H21Cl2NO (C18 H21 Cl2 NO)

Compound Name

1-(5,7-dichloro-2,3,4,4a-tetrahydro-1H-xanthen-4a-yl)piperidine

IUPAC name

1-(57-dichloro-2344a-tetrahydro-1H-xanthen-4a-yl)piperidine

SMILES

Clc(cc1C=C2CCCC3)cc(Cl)c1OC23N1CCCCC1

InChI

InChI=1S/C18H21Cl2NO/c19-15-11-13-10-14-6-2-3-7-18(14,21-8-4-1-5-9-21)22-17(13)16(20)12-15/h10-12H,1-9H2/t18-/m0/s1

InChI Key

RTKAPRCEVJCYGI-SFHVURJKSA-N

MDL Number (MFCD)

MFCD01827011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.28

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.675

Distribution Coefficient, logD

5.630

Water Solubility, LogSw

-6.10

Polar Surface Area

9.511

Acid Dissociation Constant (pKa)

27.44

Base Dissociation Constant (pKb)

6.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

3824-0020 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3824-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3824-0020?
Check Price and Availability of 3824-0020, 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 3824-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3824-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3824-0020
  • 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 3824-0020 available by request