8015-4439 Screening compound: (4-benzylpiperidino)(4-bromophenyl)methanethione

8015-4439 Screening compound: (4-benzylpiperidino)(4-bromophenyl)methanethione
8015-4439 Screening compound: (4-benzylpiperidino)(4-bromophenyl)methanethione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-4439
(4-benzylpiperidino)(4-bromophenyl)methanethione

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

8015-4439

Molecular Formula

C19H20BrNS (C19 H20 BrNS)

Compound Name

(4-benzylpiperidino)(4-bromophenyl)methanethione

IUPAC name

4-benzyl-1-(4-bromobenzenecarbothioyl)piperidine

SMILES

S=C(c(cc1)ccc1Br)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C19H20BrNS/c20-18-8-6-17(7-9-18)19(22)21-12-10-16(11-13-21)14-15-4-2-1-3-5-15/h1-9,16H,10-14H2

InChI Key

AGDHYDCTTQUWFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04061538

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

6.190

Distribution Coefficient, logD

6.190

Water Solubility, LogSw

-6.36

Polar Surface Area

1.915

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

References: we are preparing a list of scientific research reports with 8015-4439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-4439?
Check Price and Availability of 8015-4439, 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 8015-4439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-4439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-4439
  • 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 8015-4439 available by request